9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene

C72H34N4O2 — CID 139323453

IUPAC9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene
SMILESc1ccc2c(c1)oc1c(-c3cccc4oc5c(ccc6c5c5cc7c(c8cccc9c%10ccccc%10n7c98)c7c8ccccc8n6c57)c34)cc3c4cccc5c6c7c8ccccc8n8c9ccccc9c(cc6n(c45)c3c12)c78
InChIInChI=1S/C72H34N4O2/c1-6-24-50-35(14-1)38-20-11-22-43-60-55(75(50)66(38)43)34-49-62-54(74-53-27-9-4-17-41(53)64(60)70(49)74)31-30-45-59-37(19-13-29-58(59)78-71(45)62)48-32-46-39-21-12-23-44-61-56(76(67(39)44)69(46)65-42-18-5-10-28-57(42)77-72(48)65)33-47-36-15-2-7-25-51(36)73-52-26-8-3-16-40(52)63(61)68(47)73/h1-34H
InChIKeyHRCPEKGJWFDVKB-UHFFFAOYSA-N
MW987.09 g/mol
LogP19.75
Rot. Bonds1

About 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene

9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene (PubChem CID 139323453) has the molecular formula C72H34N4O2 and a molecular weight of 987.09 g/mol. Its IUPAC name is 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene.

Molecular Properties

Compound Name9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene
PubChem CID139323453
Molecular FormulaC72H34N4O2
Molecular Weight987.09 g/mol
Exact Mass986.27
IUPAC Name9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene
SMILESc1ccc2c(c1)oc1c(-c3cccc4oc5c(ccc6c5c5cc7c(c8cccc9c%10ccccc%10n7c98)c7c8ccccc8n6c57)c34)cc3c4cccc5c6c7c8ccccc8n8c9ccccc9c(cc6n(c45)c3c12)c78
InChIInChI=1S/C72H34N4O2/c1-6-24-50-35(14-1)38-20-11-22-43-60-55(75(50)66(38)43)34-49-62-54(74-53-27-9-4-17-41(53)64(60)70(49)74)31-30-45-59-37(19-13-29-58(59)78-71(45)62)48-32-46-39-21-12-23-44-61-56(76(67(39)44)69(46)65-42-18-5-10-28-57(42)77-72(48)65)33-47-36-15-2-7-25-51(36)73-52-26-8-3-16-40(52)63(61)68(47)73/h1-34H
InChIKeyHRCPEKGJWFDVKB-UHFFFAOYSA-N
XLogP19.75
TPSA43.92 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500987.09
LogP ≤ 519.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-diphenyl-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24(39),25,27,29,31,33-octadecaen-27-amine
CID 167104930
9,31-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.08,16.010,15.028,40.030,38.032,37.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7,10,12,14,16,19(46),20,22,25,28(40),29,32,34,36,38,41(45),42-henicosaene;10,32-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.09,17.011,16.028,40.031,39.033,38.041,45.023,46]hexatetraconta-1(45),2,4(24),6(18),7,9(17),11,13,15,19,21,23(46),25,28(40),29,31(39),33,35,37,41,43-henicosaene;14,36-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.07,15.08,13.028,40.029,37.030,35.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7(15),8,10,12,16,19(46),20,22,25,28(40),29(37),30,32,34,38,41(45),42-henicosaene;15,37-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.08,16.09,14.028,40.030,38.031,36.041,45.023,46]hexatetraconta-1(45),2,4(24),6(18),7,9,11,13,16,19,21,23(46),25,28(40),29,31,33,35,38,41,43-henicosaene;16,38-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.09,17.010,15.028,40.031,39.032,37.041,45.023,46]hexatetraconta-1(45),2,4(24),6(18),7,9(17),10,12,14,19,21,23(46),25,28(40),29,31(39),32,34,36,41,43-henicosaene
CID 157361153
12-oxa-1,38-diazadodecacyclo[21.18.1.127,31.02,14.05,13.06,11.015,42.016,21.024,41.026,39.032,37.038,43]tritetraconta-2(14),3,5(13),6,8,10,15(42),16,18,20,22,24(41),25,27,29,31(43),32,34,36,39-icosaene
CID 162480187
9,31-di(dibenzofuran-4-yl)-5,9,27,31-tetrazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.08,16.010,15.028,40.030,38.032,37.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7,10,12,14,16,19(46),20,22,25,28(40),29,32,34,36,38,41(45),42-henicosaene;15,37-di(dibenzofuran-4-yl)-5,15,27,37-tetrazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.08,16.09,14.028,40.030,38.031,36.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7,9,11,13,16,19(46),20,22,25,28(40),29,31,33,35,38,41(45),42-henicosaene;1,7,28,34-tetrazaheptadecacyclo[30.22.1.15,21.17,14.134,41.02,31.04,29.06,19.08,13.022,27.033,46.035,40.048,55.049,54.018,58.028,57.045,56]octapentaconta-2(31),3,5(57),6(19),8,10,12,14(58),15,17,20,22,24,26,29,32(55),33(46),35,37,39,41(56),42,44,47,49,51,53-heptacosaene;1,18,28,45-tetrazaheptadecacyclo[30.22.1.15,21.17,11.134,38.02,31.04,29.06,19.012,17.022,27.033,46.039,44.048,55.049,54.018,58.028,57.045,56]octapentaconta-2(31),3,5(57),6(19),7,9,11(58),12,14,16,20,22,24,26,29,32(55),33(46),34,36,38(56),39,41,43,47,49,51,53-heptacosaene;5,14,32,41-tetrazaheptadecacyclo[30.22.1.15,12.114,21.141,48.02,31.04,29.06,11.013,26.015,20.033,38.039,55.040,53.042,47.025,57.028,58.052,56]octapentaconta-1(55),2,4(29),6,8,10,12,15,17,19,21(57),22,24,26,28(58),30,33,35,37,39,42,44,46,48(56),49,51,53-heptacosaene;5,25,32,52-tetrazaheptadecacyclo[30.22.1.15,12.114,18.141,45.02,31.04,29.06,11.013,26.019,24.033,38.039,55.040,53.046,51.025,57.028,58.052,56]octapentaconta-1(54),2,4(29),6,8,10,12(58),13(26),14,16,18(57),19,21,23,27,30,33,35,37,39(55),40(53),41,43,45(56),46,48,50-heptacosaene
CID 159455826
10-dibenzofuran-3-yl-10,15-diazaheptacyclo[13.10.1.02,14.03,11.04,9.016,21.022,26]hexacosa-1(25),2(14),3(11),4,6,8,12,16,18,20,22(26),23-dodecaene;11-dibenzofuran-3-yl-1,11-diazaheptacyclo[13.10.1.02,14.04,12.05,10.019,26.020,25]hexacosa-2(14),3,5,7,9,12,15,17,19(26),20,22,24-dodecaene;23-dibenzofuran-3-yl-8,23-diazaheptacyclo[13.10.1.02,7.08,26.09,14.016,24.017,22]hexacosa-1(25),2,4,6,9,11,13,15(26),16(24),17,19,21-dodecaene
CID 163891075
3,29-dioxa-19-azanonacyclo[17.13.1.02,10.04,9.012,33.013,18.020,32.022,30.023,28]tritriaconta-1(33),2(10),4,6,8,11,13,15,17,20(32),21,23,25,27,30-pentadecaene;9,29-dioxa-19-azanonacyclo[17.13.1.02,10.03,8.012,33.013,18.020,32.022,30.023,28]tritriaconta-1(33),2(10),3,5,7,11,13,15,17,20(32),21,23,25,27,30-pentadecaene;10,23-dioxa-1-azanonacyclo[17.13.1.02,7.08,33.09,17.011,16.020,32.022,30.024,29]tritriaconta-2,4,6,8,11,13,15,17,19(33),20(32),21,24,26,28,30-pentadecaene;16,23-dioxa-1-azanonacyclo[17.13.1.02,7.08,33.09,17.010,15.020,32.022,30.024,29]tritriaconta-2,4,6,8(33),9(17),10,12,14,18,20(32),21,24,26,28,30-pentadecaene
CID 159284825
5,20-di(dibenzofuran-1-yl)-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1(31),2(32),3(8),4,6,10,12,14,16,18(23),19,21,25,27,29-pentadecaene
CID 154591217
10-phenyl-34-oxa-1,10,20-triazaundecacyclo[19.17.1.12,13.03,11.04,9.014,19.025,39.026,38.027,35.028,33.020,40]tetraconta-2(40),3(11),4,6,8,12,14,16,18,21,23,25(39),26(38),27(35),28,30,32,36-octadecaene
CID 171595288
10,10-diphenyl-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.04,9.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),4,6,8,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene
CID 138745289
17-oxa-8-azaheptacyclo[13.10.1.02,7.08,26.09,14.016,24.018,23]hexacosa-1(26),2(7),3,5,9,11,13,15,18,20,22,24-dodecaen-5-ol
CID 148945291
13,35-di(dibenzofuran-4-yl)-1,13,23,35-tetrazatridecacyclo[25.17.1.15,16.02,26.04,24.06,14.07,12.017,22.028,36.029,34.038,45.039,44.023,46]hexatetraconta-2(26),3,5(46),6(14),7,9,11,15,17,19,21,24,27(45),28(36),29,31,33,37,39,41,43-henicosaene
CID 146497228
8,30-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.07,15.09,14.028,40.029,37.031,36.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7(15),9,11,13,16,19(46),20,22,25,28(40),29(37),31,33,35,38,41(45),42-henicosaene;9,31-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.08,16.010,15.028,40.030,38.032,37.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7,10,12,14,16,19(46),20,22,25,28(40),29,32,34,36,38,41(45),42-henicosaene;14,36-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.07,15.08,13.028,40.029,37.030,35.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7(15),8,10,12,16,19(46),20,22,25,28(40),29(37),30,32,34,38,41(45),42-henicosaene;15,37-dioxa-5,27-diazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.08,16.09,14.028,40.030,38.031,36.041,45.023,46]hexatetraconta-1(45),2,4(24),6(18),7,9,11,13,16,19,21,23(46),25,28(40),29,31,33,35,38,41,43-henicosaene;3,25-di(propan-2-yl)-14,36-dioxa-5,27-diazatridecacyclo[25.17.1.15,12.02,26.04,24.06,11.013,21.015,20.028,33.034,45.035,43.037,42.023,46]hexatetraconta-1(45),2,4(24),6,8,10,12,15,17,19,21,23(46),25,28,30,32,34,37,39,41,43-henicosaene;3,25-di(propan-2-yl)-20,42-dioxa-5,27-diazatridecacyclo[25.17.1.15,12.02,26.04,24.06,11.013,21.014,19.028,33.034,45.035,43.036,41.023,46]hexatetraconta-1(44),2,4(24),6,8,10,12(46),13(21),14,16,18,22,25,28,30,32,34(45),35(43),36,38,40-henicosaene
CID 158052366

Frequently Asked Questions

What is the IUPAC name of 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene?
The IUPAC name of 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene (CID 139323453) is 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene.
What is the SMILES notation for 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene?
The canonical SMILES for 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene is c1ccc2c(c1)oc1c(-c3cccc4oc5c(ccc6c5c5cc7c(c8cccc9c%10ccccc%10n7c98)c7c8ccccc8n6c57)c34)cc3c4cccc5c6c7c8ccccc8n8c9ccccc9c(cc6n(c45)c3c12)c78.
What is the InChIKey of 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene?
The InChIKey is HRCPEKGJWFDVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H34N4O2/c1-6-24-50-35(14-1)38-20-11-22-43-60-55(75(50)66(38)43)34-49-62-54(74-53-27-9-4-17-41(53)64(60)70(49)74)31-30-45-59-37(19-13-29-58(59)78-71(45)62)48-32-46-39-21-12-23-44-61-56(76(67(39)44)69(46)65-42-18-5-10-28-57(42)77-72(48)65)33-47-36-15-2-7-25-51(36)73-52-26-8-3-16-40(52)63(61)68(47)73/h1-34H.
What are the key properties of 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene?
9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene has a molecular weight of 987.09 g/mol, XLogP of 19.75, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(29-oxa-10,20-diazaundecacyclo[18.17.1.13,10.02,19.04,9.011,16.021,33.022,30.023,28.034,38.017,39]nonatriaconta-1(37),2(19),3(39),4,6,8,11,13,15,17,21,23,25,27,30,32,34(38),35-octadecaen-31-yl)-4-oxa-15,35-diazaundecacyclo[20.15.1.124,28.02,14.03,11.05,10.015,38.016,21.023,36.029,34.035,39]nonatriaconta-1(37),2(14),3(11),5,7,9,12,16,18,20,22(38),23(36),24,26,28(39),29,31,33-octadecaene is sourced from PubChem (CID 139323453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).