8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene

C358H252 — CID 159781506

IUPAC8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene
SMILESCC1(C)c2c3c(c4ccccc4c2-c2cc4ccc5cccc6ccc(c21)c4c56)-c1cc2ccc4cccc5ccc(c1C3(C)C)c2c45.CC1(C)c2cc3c(ccc4ccccc43)cc2-c2c1c1c(c3ccccc23)-c2cc3ccc4ccccc4c3cc2C1(C)C.CC1(C)c2cc3c4c(cccc4c2-c2c1cc1ccc4c5c(cc6ccc2c1c64)C(C)(C)c1cc2c4c(cccc4c1-5)-c1ccccc1-2)-c1ccccc1-3.CC1(C)c2cc3c4ccccc4c4ccccc4c3cc2-c2c1cc1ccc3c4c(cc5ccc2c1c53)C(C)(C)c1cc2c3ccccc3c3ccccc3c2cc1-4.CC1(C)c2cc3ccccc3cc2-c2c1c1c(c3c2ccc2ccccc23)-c2cc3ccccc3cc2C1(C)C.CC1(C)c2ccc3ccccc3c2-c2ccc3c4c(ccc3c21)-c1c(cc2ccc3cccc5ccc1c2c35)C4(C)C.CC1(C)c2ccc3ccccc3c2-c2ccc3c4c(ccc3c21)-c1c(ccc2ccccc12)C4(C)C.CC1(C)c2ccccc2-c2c1c1c(c3ccccc23)-c2cc3cc4ccccc4cc3cc2C1(C)C
InChIInChI=1S/C58H38.C54H34.C48H32.C44H32.C42H30.C40H30.2C36H28/c1-57(2)49-29-45-39-19-11-7-15-35(39)33-13-5-9-17-37(33)43(45)27-47(49)55-41-23-22-32-26-52-56(42-24-21-31(25-51(55)57)53(41)54(32)42)48-28-44-38-18-10-6-14-34(38)36-16-8-12-20-40(36)46(44)30-50(48)58(52,3)4;1-53(2)41-23-27-19-22-38-46-28(24-42-52(38)50-36-18-10-16-34-30-12-6-8-14-32(30)40(48(34)36)26-44(50)54(42,3)4)20-21-37(45(27)46)51(41)49-35-17-9-15-33-29-11-5-7-13-31(29)39(47(33)35)25-43(49)53;1-47(2)43-33-21-19-27-11-7-9-25-15-17-29(39(33)37(25)27)23-35(43)41-31-13-5-6-14-32(31)42-36-24-30-18-16-26-10-8-12-28-20-22-34(40(30)38(26)28)44(36)48(3,4)46(42)45(41)47;1-43(2)37-23-33-27(19-17-25-11-5-7-13-29(25)33)21-35(37)39-31-15-9-10-16-32(31)40-36-22-28-20-18-26-12-6-8-14-30(26)34(28)24-38(36)44(3,4)42(40)41(39)43;1-41(2)33-21-15-23-8-5-6-11-27(23)37(33)31-19-17-29-28(39(31)41)18-20-32-38-30-16-14-25-10-7-9-24-12-13-26(36(30)35(24)25)22-34(38)42(3,4)40(29)32;1-39(2)32-21-26-14-7-5-12-24(26)19-30(32)35-29-18-17-23-11-9-10-16-28(23)34(29)36-31-20-25-13-6-8-15-27(25)22-33(31)40(3,4)38(36)37(35)39;1-35(2)29-19-13-21-9-5-7-11-23(21)31(29)27-17-16-26-25(33(27)35)15-18-28-32-24-12-8-6-10-22(24)14-20-30(32)36(3,4)34(26)28;1-35(2)29-16-10-9-15-27(29)31-25-13-7-8-14-26(25)32-28-19-23-17-21-11-5-6-12-22(21)18-24(23)20-30(28)36(3,4)34(32)33(31)35/h5-30H,1-4H3;5-26H,1-4H3;5-24H,1-4H3;5-24H,1-4H3;5-22H,1-4H3;5-22H,1-4H3;2*5-20H,1-4H3
InChIKeyNHKLXPLUKVMQMZ-UHFFFAOYSA-N
MW4553.95 g/mol
LogP98.16
Rot. Bonds

About 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene

8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene (PubChem CID 159781506) has the molecular formula C358H252 and a molecular weight of 4553.95 g/mol. Its IUPAC name is 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene.

Molecular Properties

Compound Name8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene
PubChem CID159781506
Molecular FormulaC358H252
Molecular Weight4553.95 g/mol
Exact Mass4549.97
IUPAC Name8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene
SMILESCC1(C)c2c3c(c4ccccc4c2-c2cc4ccc5cccc6ccc(c21)c4c56)-c1cc2ccc4cccc5ccc(c1C3(C)C)c2c45.CC1(C)c2cc3c(ccc4ccccc43)cc2-c2c1c1c(c3ccccc23)-c2cc3ccc4ccccc4c3cc2C1(C)C.CC1(C)c2cc3c4c(cccc4c2-c2c1cc1ccc4c5c(cc6ccc2c1c64)C(C)(C)c1cc2c4c(cccc4c1-5)-c1ccccc1-2)-c1ccccc1-3.CC1(C)c2cc3c4ccccc4c4ccccc4c3cc2-c2c1cc1ccc3c4c(cc5ccc2c1c53)C(C)(C)c1cc2c3ccccc3c3ccccc3c2cc1-4.CC1(C)c2cc3ccccc3cc2-c2c1c1c(c3c2ccc2ccccc23)-c2cc3ccccc3cc2C1(C)C.CC1(C)c2ccc3ccccc3c2-c2ccc3c4c(ccc3c21)-c1c(cc2ccc3cccc5ccc1c2c35)C4(C)C.CC1(C)c2ccc3ccccc3c2-c2ccc3c4c(ccc3c21)-c1c(ccc2ccccc12)C4(C)C.CC1(C)c2ccccc2-c2c1c1c(c3ccccc23)-c2cc3cc4ccccc4cc3cc2C1(C)C
InChIInChI=1S/C58H38.C54H34.C48H32.C44H32.C42H30.C40H30.2C36H28/c1-57(2)49-29-45-39-19-11-7-15-35(39)33-13-5-9-17-37(33)43(45)27-47(49)55-41-23-22-32-26-52-56(42-24-21-31(25-51(55)57)53(41)54(32)42)48-28-44-38-18-10-6-14-34(38)36-16-8-12-20-40(36)46(44)30-50(48)58(52,3)4;1-53(2)41-23-27-19-22-38-46-28(24-42-52(38)50-36-18-10-16-34-30-12-6-8-14-32(30)40(48(34)36)26-44(50)54(42,3)4)20-21-37(45(27)46)51(41)49-35-17-9-15-33-29-11-5-7-13-31(29)39(47(33)35)25-43(49)53;1-47(2)43-33-21-19-27-11-7-9-25-15-17-29(39(33)37(25)27)23-35(43)41-31-13-5-6-14-32(31)42-36-24-30-18-16-26-10-8-12-28-20-22-34(40(30)38(26)28)44(36)48(3,4)46(42)45(41)47;1-43(2)37-23-33-27(19-17-25-11-5-7-13-29(25)33)21-35(37)39-31-15-9-10-16-32(31)40-36-22-28-20-18-26-12-6-8-14-30(26)34(28)24-38(36)44(3,4)42(40)41(39)43;1-41(2)33-21-15-23-8-5-6-11-27(23)37(33)31-19-17-29-28(39(31)41)18-20-32-38-30-16-14-25-10-7-9-24-12-13-26(36(30)35(24)25)22-34(38)42(3,4)40(29)32;1-39(2)32-21-26-14-7-5-12-24(26)19-30(32)35-29-18-17-23-11-9-10-16-28(23)34(29)36-31-20-25-13-6-8-15-27(25)22-33(31)40(3,4)38(36)37(35)39;1-35(2)29-19-13-21-9-5-7-11-23(21)31(29)27-17-16-26-25(33(27)35)15-18-28-32-24-12-8-6-10-22(24)14-20-30(32)36(3,4)34(26)28;1-35(2)29-16-10-9-15-27(29)31-25-13-7-8-14-26(25)32-28-19-23-17-21-11-5-6-12-22(21)18-24(23)20-30(28)36(3,4)34(32)33(31)35/h5-30H,1-4H3;5-26H,1-4H3;5-24H,1-4H3;5-24H,1-4H3;5-22H,1-4H3;5-22H,1-4H3;2*5-20H,1-4H3
InChIKeyNHKLXPLUKVMQMZ-UHFFFAOYSA-N
XLogP98.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms358
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004553.95
LogP ≤ 598.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene?
The IUPAC name of 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene (CID 159781506) is 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene.
What is the SMILES notation for 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene?
The canonical SMILES for 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene is CC1(C)c2c3c(c4ccccc4c2-c2cc4ccc5cccc6ccc(c21)c4c56)-c1cc2ccc4cccc5ccc(c1C3(C)C)c2c45.CC1(C)c2cc3c(ccc4ccccc43)cc2-c2c1c1c(c3ccccc23)-c2cc3ccc4ccccc4c3cc2C1(C)C.CC1(C)c2cc3c4c(cccc4c2-c2c1cc1ccc4c5c(cc6ccc2c1c64)C(C)(C)c1cc2c4c(cccc4c1-5)-c1ccccc1-2)-c1ccccc1-3.CC1(C)c2cc3c4ccccc4c4ccccc4c3cc2-c2c1cc1ccc3c4c(cc5ccc2c1c53)C(C)(C)c1cc2c3ccccc3c3ccccc3c2cc1-4.CC1(C)c2cc3ccccc3cc2-c2c1c1c(c3c2ccc2ccccc23)-c2cc3ccccc3cc2C1(C)C.CC1(C)c2ccc3ccccc3c2-c2ccc3c4c(ccc3c21)-c1c(cc2ccc3cccc5ccc1c2c35)C4(C)C.CC1(C)c2ccc3ccccc3c2-c2ccc3c4c(ccc3c21)-c1c(ccc2ccccc12)C4(C)C.CC1(C)c2ccccc2-c2c1c1c(c3ccccc23)-c2cc3cc4ccccc4cc3cc2C1(C)C.
What is the InChIKey of 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene?
The InChIKey is NHKLXPLUKVMQMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38.C54H34.C48H32.C44H32.C42H30.C40H30.2C36H28/c1-57(2)49-29-45-39-19-11-7-15-35(39)33-13-5-9-17-37(33)43(45)27-47(49)55-41-23-22-32-26-52-56(42-24-21-31(25-51(55)57)53(41)54(32)42)48-28-44-38-18-10-6-14-34(38)36-16-8-12-20-40(36)46(44)30-50(48)58(52,3)4;1-53(2)41-23-27-19-22-38-46-28(24-42-52(38)50-36-18-10-16-34-30-12-6-8-14-32(30)40(48(34)36)26-44(50)54(42,3)4)20-21-37(45(27)46)51(41)49-35-17-9-15-33-29-11-5-7-13-31(29)39(47(33)35)25-43(49)53;1-47(2)43-33-21-19-27-11-7-9-25-15-17-29(39(33)37(25)27)23-35(43)41-31-13-5-6-14-32(31)42-36-24-30-18-16-26-10-8-12-28-20-22-34(40(30)38(26)28)44(36)48(3,4)46(42)45(41)47;1-43(2)37-23-33-27(19-17-25-11-5-7-13-29(25)33)21-35(37)39-31-15-9-10-16-32(31)40-36-22-28-20-18-26-12-6-8-14-30(26)34(28)24-38(36)44(3,4)42(40)41(39)43;1-41(2)33-21-15-23-8-5-6-11-27(23)37(33)31-19-17-29-28(39(31)41)18-20-32-38-30-16-14-25-10-7-9-24-12-13-26(36(30)35(24)25)22-34(38)42(3,4)40(29)32;1-39(2)32-21-26-14-7-5-12-24(26)19-30(32)35-29-18-17-23-11-9-10-16-28(23)34(29)36-31-20-25-13-6-8-15-27(25)22-33(31)40(3,4)38(36)37(35)39;1-35(2)29-19-13-21-9-5-7-11-23(21)31(29)27-17-16-26-25(33(27)35)15-18-28-32-24-12-8-6-10-22(24)14-20-30(32)36(3,4)34(26)28;1-35(2)29-16-10-9-15-27(29)31-25-13-7-8-14-26(25)32-28-19-23-17-21-11-5-6-12-22(21)18-24(23)20-30(28)36(3,4)34(32)33(31)35/h5-30H,1-4H3;5-26H,1-4H3;5-24H,1-4H3;5-24H,1-4H3;5-22H,1-4H3;5-22H,1-4H3;2*5-20H,1-4H3.
What are the key properties of 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene?
8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene has a molecular weight of 4553.95 g/mol, XLogP of 98.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8,24,24-tetramethyldecacyclo[28.6.2.02,25.03,23.06,22.07,19.09,18.012,17.027,37.034,38]octatriaconta-1(37),2(25),3(23),4,6(22),7(19),9(18),10,12,14,16,20,26,28,30(38),31,33,35-octadecaene;3,3,40,40-tetramethyldecacyclo[23.15.0.02,18.04,17.06,15.07,12.019,24.026,39.028,37.031,36]tetraconta-1(25),2(18),4(17),5,7,9,11,13,15,19,21,23,26(39),27,29,31,33,35,37-nonadecaene;3,3,6,6-tetramethyldodecacyclo[32.6.2.28,11.02,29.04,28.05,21.07,20.09,18.010,15.022,27.031,41.038,42]tetratetraconta-1(41),2(29),4(28),5(21),7(20),8,10(15),11,13,16,18,22,24,26,30,32,34(42),35,37,39,43-henicosaene;23,23,26,26-tetramethylnonacyclo[23.11.0.02,11.03,8.012,24.013,22.015,20.027,36.029,34]hexatriaconta-1(25),2(11),3,5,7,9,12(24),13,15,17,19,21,27,29,31,33,35-heptadecaene;3,3,19,19-tetramethyloctacyclo[15.15.0.02,14.04,13.07,12.018,30.020,29.023,28]dotriaconta-1(17),2(14),4(13),5,7,9,11,15,18(30),20(29),21,23,25,27,31-pentadecaene;16,16,19,19-tetramethyloctacyclo[15.15.0.02,15.04,13.06,11.018,26.020,25.027,32]dotriaconta-1(17),2,4,6,8,10,12,14,18(26),20,22,24,27,29,31-pentadecaene;18,18,41,41-tetramethyltetradecacyclo[22.22.2.14,8.127,31.02,19.03,17.09,14.021,47.025,42.026,40.032,37.044,48.015,50.038,49]pentaconta-1(47),2(19),3(17),4(50),5,7,9,11,13,15,20,22,24(48),25(42),26(40),27(49),28,30,32,34,36,38,43,45-tetracosaene;21,21,47,47-tetramethyltetradecacyclo[25.25.2.02,22.03,20.05,18.06,11.012,17.024,53.028,48.029,46.031,44.032,37.038,43.050,54]tetrapentaconta-1(53),2(22),3(20),4,6,8,10,12,14,16,18,23,25,27(54),28(48),29(46),30,32,34,36,38,40,42,44,49,51-hexacosaene is sourced from PubChem (CID 159781506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).