12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene

C346H272N16O8Sn6 — CID 159693174

IUPAC12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
SMILESCC(C)(C)c1ccc(N2c3cc(-c4ccccc4)cc4c3[Sn]3(C)c5c(cc(-c6ccccc6)cc5N(c5ccc(C(C)(C)C)cc5)c5cc(-c6ccccc6)cc2c53)O4)cc1.CC(C)(C)c1ccc(N2c3cc(C(C)(C)C)cc4c3[Sn]3(c5ccccc5)c5c(cc(C(C)(C)C)cc5N(c5ccc(C(C)(C)C)cc5)c5cc(-n6c7ccccc7c7ccccc76)cc2c53)O4)cc1.C[Sn]12c3c4cccc3N(c3ccc5ccccc5c3)c3cccc(c31)N(c1ccc3ccccc3c1)c1cccc(c12)O4.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c4c(cc5ccccc15)Oc1cc5ccccc5c(c1[Sn]34C)N2c1ccc(C(C)(C)C)cc1.Cc1cc2c3c(c1)N(c1ccccc1)c1cc(-c4ccc5oc6cc7ccccc7cc6c5c4)cc4c1[Sn]3(c1ccccc1)c1c(cc(-c3ccc5oc6cc7ccccc7cc6c5c3)cc1N2c1ccccc1)O4.Cc1ccc(N2c3cc(-n4c5ccccc5c5ccccc54)cc4c3[Sn]3(C)c5c(cc(-n6c7ccccc7c7ccccc76)cc5N(c5ccc(C)cc5)c5cc(-n6c7ccccc7c7ccccc76)cc2c53)O4)cc1
InChIInChI=1S/C68H44N5O.C63H37N2O3.C58H58N3O.C56H47N2O.C47H41N2O.C38H23N2O.2C6H5.4CH3.6Sn/c1-44-27-31-46(32-28-44)69-48-35-49(37-50(36-48)71-63-21-9-3-15-57(63)58-16-4-10-22-64(58)71)70(47-33-29-45(2)30-34-47)52-39-54(73-67-25-13-7-19-61(67)62-20-8-14-26-68(62)73)43-56(41-52)74-55-40-51(69)38-53(42-55)72-65-23-11-5-17-59(65)60-18-6-12-24-66(60)72;1-39-24-50-36-51(25-39)65(49-18-6-3-7-19-49)53-27-47(45-21-23-61-57(33-45)59-31-41-13-9-11-15-43(41)35-63(59)68-61)29-55(38-53)66-54-28-46(26-52(37-54)64(50)48-16-4-2-5-17-48)44-20-22-60-56(32-44)58-30-40-12-8-10-14-42(40)34-62(58)67-60;1-55(2,3)38-21-25-42(26-22-38)59-44-29-40(57(7,8)9)31-49(36-44)62-50-32-41(58(10,11)12)30-45(37-50)60(43-27-23-39(24-28-43)56(4,5)6)47-33-46(59)34-48(35-47)61-53-19-15-13-17-51(53)52-18-14-16-20-54(52)61;1-55(2,3)45-22-26-47(27-23-45)57-49-30-42(39-16-10-7-11-17-39)31-50(36-49)58(48-28-24-46(25-29-48)56(4,5)6)52-33-44(41-20-14-9-15-21-41)35-54(38-52)59-53-34-43(32-51(57)37-53)40-18-12-8-13-19-40;1-31-24-38-28-39(25-31)49(37-22-18-35(19-23-37)47(5,6)7)45-30-41(27-33-13-9-11-15-43(33)45)50-40-26-32-12-8-10-14-42(32)44(29-40)48(38)36-20-16-34(17-21-36)46(2,3)4;1-3-10-29-22-35(20-18-27(29)8-1)39-31-12-5-13-32(24-31)40(36-21-19-28-9-2-4-11-30(28)23-36)34-15-7-17-38(26-34)41-37-16-6-14-33(39)25-37;2*1-2-4-6-5-3-1;;;;;;;;;;/h3-34,36-39,42-43H,1-2H3;2-35H,1H3;13-32,34-35H,1-12H3;7-35H,1-6H3;8-27H,1-7H3;1-23H;2*1-5H;4*1H3;;;;;;
InChIKeyMWRBAVDXSRLNFP-UHFFFAOYSA-N
MW5494.35 g/mol
LogP82.36
Rot. Bonds23

About 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene

12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene (PubChem CID 159693174) has the molecular formula C346H272N16O8Sn6 and a molecular weight of 5494.35 g/mol. Its IUPAC name is 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene.

Molecular Properties

Compound Name12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
PubChem CID159693174
Molecular FormulaC346H272N16O8Sn6
Molecular Weight5494.35 g/mol
Exact Mass5497.55
IUPAC Name12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
SMILESCC(C)(C)c1ccc(N2c3cc(-c4ccccc4)cc4c3[Sn]3(C)c5c(cc(-c6ccccc6)cc5N(c5ccc(C(C)(C)C)cc5)c5cc(-c6ccccc6)cc2c53)O4)cc1.CC(C)(C)c1ccc(N2c3cc(C(C)(C)C)cc4c3[Sn]3(c5ccccc5)c5c(cc(C(C)(C)C)cc5N(c5ccc(C(C)(C)C)cc5)c5cc(-n6c7ccccc7c7ccccc76)cc2c53)O4)cc1.C[Sn]12c3c4cccc3N(c3ccc5ccccc5c3)c3cccc(c31)N(c1ccc3ccccc3c1)c1cccc(c12)O4.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c4c(cc5ccccc15)Oc1cc5ccccc5c(c1[Sn]34C)N2c1ccc(C(C)(C)C)cc1.Cc1cc2c3c(c1)N(c1ccccc1)c1cc(-c4ccc5oc6cc7ccccc7cc6c5c4)cc4c1[Sn]3(c1ccccc1)c1c(cc(-c3ccc5oc6cc7ccccc7cc6c5c3)cc1N2c1ccccc1)O4.Cc1ccc(N2c3cc(-n4c5ccccc5c5ccccc54)cc4c3[Sn]3(C)c5c(cc(-n6c7ccccc7c7ccccc76)cc5N(c5ccc(C)cc5)c5cc(-n6c7ccccc7c7ccccc76)cc2c53)O4)cc1
InChIInChI=1S/C68H44N5O.C63H37N2O3.C58H58N3O.C56H47N2O.C47H41N2O.C38H23N2O.2C6H5.4CH3.6Sn/c1-44-27-31-46(32-28-44)69-48-35-49(37-50(36-48)71-63-21-9-3-15-57(63)58-16-4-10-22-64(58)71)70(47-33-29-45(2)30-34-47)52-39-54(73-67-25-13-7-19-61(67)62-20-8-14-26-68(62)73)43-56(41-52)74-55-40-51(69)38-53(42-55)72-65-23-11-5-17-59(65)60-18-6-12-24-66(60)72;1-39-24-50-36-51(25-39)65(49-18-6-3-7-19-49)53-27-47(45-21-23-61-57(33-45)59-31-41-13-9-11-15-43(41)35-63(59)68-61)29-55(38-53)66-54-28-46(26-52(37-54)64(50)48-16-4-2-5-17-48)44-20-22-60-56(32-44)58-30-40-12-8-10-14-42(40)34-62(58)67-60;1-55(2,3)38-21-25-42(26-22-38)59-44-29-40(57(7,8)9)31-49(36-44)62-50-32-41(58(10,11)12)30-45(37-50)60(43-27-23-39(24-28-43)56(4,5)6)47-33-46(59)34-48(35-47)61-53-19-15-13-17-51(53)52-18-14-16-20-54(52)61;1-55(2,3)45-22-26-47(27-23-45)57-49-30-42(39-16-10-7-11-17-39)31-50(36-49)58(48-28-24-46(25-29-48)56(4,5)6)52-33-44(41-20-14-9-15-21-41)35-54(38-52)59-53-34-43(32-51(57)37-53)40-18-12-8-13-19-40;1-31-24-38-28-39(25-31)49(37-22-18-35(19-23-37)47(5,6)7)45-30-41(27-33-13-9-11-15-43(33)45)50-40-26-32-12-8-10-14-42(32)44(29-40)48(38)36-20-16-34(17-21-36)46(2,3)4;1-3-10-29-22-35(20-18-27(29)8-1)39-31-12-5-13-32(24-31)40(36-21-19-28-9-2-4-11-30(28)23-36)34-15-7-17-38(26-34)41-37-16-6-14-33(39)25-37;2*1-2-4-6-5-3-1;;;;;;;;;;/h3-34,36-39,42-43H,1-2H3;2-35H,1H3;13-32,34-35H,1-12H3;7-35H,1-6H3;8-27H,1-7H3;1-23H;2*1-5H;4*1H3;;;;;;
InChIKeyMWRBAVDXSRLNFP-UHFFFAOYSA-N
XLogP82.36
TPSA140.26 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds23
Heavy Atoms376
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005494.35
LogP ≤ 582.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene with MolForge

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Related Compounds

17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
CID 140848883
5,11,17-tri(carbazol-9-yl)-22-(4-methylphenyl)-1-phenyl-8,14-dioxa-22-aza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 154595318
6,22-bis(4-tert-butylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6,22-di(carbazol-9-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6,22-di(dibenzofuran-2-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6,22-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene
CID 163903431
10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
CID 134475798
15-[3-(6,9-diphenylcarbazol-3-yl)carbazol-9-yl]-12,18-dioxa-1-azaheptacyclo[15.11.1.02,11.04,9.013,29.019,28.021,26]nonacosa-2,4,6,8,10,13,15,17(29),19,21,23,25,27-tridecaene
CID 129289172
3-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)phenoxazine
CID 134475961
6,22-bis(4-tert-butylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6,22-di(carbazol-9-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6,22-di(dibenzofuran-2-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6,22-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene;6-N,6-N,22-N,22-N-tetraphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2(11),3,5,7,9,12(27),13,15,17(26),18,20,22,24-tridecaene-6,22-diamine
CID 159039634
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;bis(9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole)
CID 161012876
7-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)indolo[2,3-b]carbazole;2-(9-phenylcarbazol-3-yl)-5,7-bis(4-phenylphenyl)indolo[2,3-b]carbazole;10-(9-phenylcarbazol-3-yl)-7-(4-phenylphenyl)-[1]benzofuro[2,3-b]carbazole
CID 158696933
15-tert-butyl-18-(4-tert-butyl-2,6-diphenylphenyl)-22-(4-tert-butylphenyl)-9,31-diphenyl-25-(9-phenylcarbazol-3-yl)-12,28-dioxa-18,22-diaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6(11),7,9,13,15,17(36),20,23(35),24,26,29(34),30,32-pentadecaene
CID 169042304
9-[3-[9-(4-tert-butylphenyl)carbazol-3-yl]-5-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]-3-naphthalen-2-yl-6-phenylcarbazole
CID 122472162
14-(4-tert-butylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12,14,16(27),17,19,21,23,25-tridecaene;14-carbazol-9-yl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12,14,16(27),17,19,21,23,25-tridecaene;14-dibenzofuran-2-yl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12,14,16(27),17,19,21,23,25-tridecaene;14-(3,5-diphenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12,14,16(27),17,19,21,23,25-tridecaene;14-(4-isocyanophenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12,14,16(27),17,19,21,23,25-tridecaene;14-phenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12,14,16(27),17,19,21,23,25-tridecaene
CID 163517527

Frequently Asked Questions

What is the IUPAC name of 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene?
The IUPAC name of 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene (CID 159693174) is 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene.
What is the SMILES notation for 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene?
The canonical SMILES for 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene is CC(C)(C)c1ccc(N2c3cc(-c4ccccc4)cc4c3[Sn]3(C)c5c(cc(-c6ccccc6)cc5N(c5ccc(C(C)(C)C)cc5)c5cc(-c6ccccc6)cc2c53)O4)cc1.CC(C)(C)c1ccc(N2c3cc(C(C)(C)C)cc4c3[Sn]3(c5ccccc5)c5c(cc(C(C)(C)C)cc5N(c5ccc(C(C)(C)C)cc5)c5cc(-n6c7ccccc7c7ccccc76)cc2c53)O4)cc1.C[Sn]12c3c4cccc3N(c3ccc5ccccc5c3)c3cccc(c31)N(c1ccc3ccccc3c1)c1cccc(c12)O4.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c4c(cc5ccccc15)Oc1cc5ccccc5c(c1[Sn]34C)N2c1ccc(C(C)(C)C)cc1.Cc1cc2c3c(c1)N(c1ccccc1)c1cc(-c4ccc5oc6cc7ccccc7cc6c5c4)cc4c1[Sn]3(c1ccccc1)c1c(cc(-c3ccc5oc6cc7ccccc7cc6c5c3)cc1N2c1ccccc1)O4.Cc1ccc(N2c3cc(-n4c5ccccc5c5ccccc54)cc4c3[Sn]3(C)c5c(cc(-n6c7ccccc7c7ccccc76)cc5N(c5ccc(C)cc5)c5cc(-n6c7ccccc7c7ccccc76)cc2c53)O4)cc1.
What is the InChIKey of 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene?
The InChIKey is MWRBAVDXSRLNFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H44N5O.C63H37N2O3.C58H58N3O.C56H47N2O.C47H41N2O.C38H23N2O.2C6H5.4CH3.6Sn/c1-44-27-31-46(32-28-44)69-48-35-49(37-50(36-48)71-63-21-9-3-15-57(63)58-16-4-10-22-64(58)71)70(47-33-29-45(2)30-34-47)52-39-54(73-67-25-13-7-19-61(67)62-20-8-14-26-68(62)73)43-56(41-52)74-55-40-51(69)38-53(42-55)72-65-23-11-5-17-59(65)60-18-6-12-24-66(60)72;1-39-24-50-36-51(25-39)65(49-18-6-3-7-19-49)53-27-47(45-21-23-61-57(33-45)59-31-41-13-9-11-15-43(41)35-63(59)68-61)29-55(38-53)66-54-28-46(26-52(37-54)64(50)48-16-4-2-5-17-48)44-20-22-60-56(32-44)58-30-40-12-8-10-14-42(40)34-62(58)67-60;1-55(2,3)38-21-25-42(26-22-38)59-44-29-40(57(7,8)9)31-49(36-44)62-50-32-41(58(10,11)12)30-45(37-50)60(43-27-23-39(24-28-43)56(4,5)6)47-33-46(59)34-48(35-47)61-53-19-15-13-17-51(53)52-18-14-16-20-54(52)61;1-55(2,3)45-22-26-47(27-23-45)57-49-30-42(39-16-10-7-11-17-39)31-50(36-49)58(48-28-24-46(25-29-48)56(4,5)6)52-33-44(41-20-14-9-15-21-41)35-54(38-52)59-53-34-43(32-51(57)37-53)40-18-12-8-13-19-40;1-31-24-38-28-39(25-31)49(37-22-18-35(19-23-37)47(5,6)7)45-30-41(27-33-13-9-11-15-43(33)45)50-40-26-32-12-8-10-14-42(32)44(29-40)48(38)36-20-16-34(17-21-36)46(2,3)4;1-3-10-29-22-35(20-18-27(29)8-1)39-31-12-5-13-32(24-31)40(36-21-19-28-9-2-4-11-30(28)23-36)34-15-7-17-38(26-34)41-37-16-6-14-33(39)25-37;2*1-2-4-6-5-3-1;;;;;;;;;;/h3-34,36-39,42-43H,1-2H3;2-35H,1H3;13-32,34-35H,1-12H3;7-35H,1-6H3;8-27H,1-7H3;1-23H;2*1-5H;4*1H3;;;;;;.
What are the key properties of 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene?
12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene has a molecular weight of 5494.35 g/mol, XLogP of 82.36, 23 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 12,18-bis(4-tert-butylphenyl)-1,15-dimethyl-30-oxa-12,18-diaza-1-stannaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene;14,22-bis(4-tert-butylphenyl)-1-methyl-5,11,17-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;5,11-ditert-butyl-14,22-bis(4-tert-butylphenyl)-17-carbazol-9-yl-1-phenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;17-methyl-5,11-bis(naphtho[2,3-b][1]benzofuran-2-yl)-1,14,22-triphenyl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;1-methyl-14,22-dinaphthalen-2-yl-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene;5,11,17-tri(carbazol-9-yl)-1-methyl-14,22-bis(4-methylphenyl)-8-oxa-14,22-diaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene is sourced from PubChem (CID 159693174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).