3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium

C275H167N14O7+ — CID 159280259

IUPAC3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium
SMILESc1cc(-c2ccc3oc4ccccc4c3c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-[n+]7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)cc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)cc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-c7cccc(-n8c9ccccc9c9ccccc98)c7)ccc65)cc4c3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3c2c1
InChIInChI=1S/C60H37N3O.C59H37N4O.2C54H32N2O2.C48H29N3O/c1-2-13-38(14-3-1)40-25-29-57-49(34-40)47-19-6-10-23-55(47)62(57)43-27-31-59-51(36-43)52-37-44(28-32-60(52)64-59)63-56-24-11-7-20-48(56)50-35-41(26-30-58(50)63)39-15-12-16-42(33-39)61-53-21-8-4-17-45(53)46-18-5-9-22-54(46)61;1-3-13-38(14-4-1)39-23-27-55-47(33-39)44-17-7-10-20-52(44)62(55)42-25-29-58-49(35-42)50-36-43(26-30-59(50)64-58)63-53-21-11-8-18-45(53)48-34-41(24-28-56(48)63)60-32-31-57-51(37-60)46-19-9-12-22-54(46)61(57)40-15-5-2-6-16-40;1-5-16-47-39(12-1)40-13-2-6-17-48(40)55(47)37-22-26-53-45(31-37)46-32-38(23-27-54(46)58-53)56-49-18-7-3-14-41(49)43-29-35(20-24-50(43)56)33-10-9-11-34(28-33)36-21-25-52-44(30-36)42-15-4-8-19-51(42)57-52;1-2-10-33(11-3-1)34-18-23-49-42(28-34)39-12-4-7-15-47(39)55(49)37-21-26-53-45(31-37)46-32-38(22-27-54(46)58-53)56-48-16-8-5-13-40(48)43-29-35(19-24-50(43)56)36-20-25-52-44(30-36)41-14-6-9-17-51(41)57-52;1-6-16-41-33(11-1)34-12-2-7-17-42(34)49(41)30-21-24-46-38(27-30)37-15-5-10-20-45(37)51(46)32-23-26-48-40(29-32)39-28-31(22-25-47(39)52-48)50-43-18-8-3-13-35(43)36-14-4-9-19-44(36)50/h2*1-37H;2*1-32H;1-29H/q;+1;;;
InChIKeyWMMHXZLGRIFIEZ-UHFFFAOYSA-N
MW3779.45 g/mol
LogP73.94
Rot. Bonds21

About 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium

3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium (PubChem CID 159280259) has the molecular formula C275H167N14O7+ and a molecular weight of 3779.45 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium.

Molecular Properties

Compound Name3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium
PubChem CID159280259
Molecular FormulaC275H167N14O7+
Molecular Weight3779.45 g/mol
Exact Mass3776.31
IUPAC Name3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium
SMILESc1cc(-c2ccc3oc4ccccc4c3c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-[n+]7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)cc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)cc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-c7cccc(-n8c9ccccc9c9ccccc98)c7)ccc65)cc4c3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3c2c1
InChIInChI=1S/C60H37N3O.C59H37N4O.2C54H32N2O2.C48H29N3O/c1-2-13-38(14-3-1)40-25-29-57-49(34-40)47-19-6-10-23-55(47)62(57)43-27-31-59-51(36-43)52-37-44(28-32-60(52)64-59)63-56-24-11-7-20-48(56)50-35-41(26-30-58(50)63)39-15-12-16-42(33-39)61-53-21-8-4-17-45(53)46-18-5-9-22-54(46)61;1-3-13-38(14-4-1)39-23-27-55-47(33-39)44-17-7-10-20-52(44)62(55)42-25-29-58-49(35-42)50-36-43(26-30-59(50)64-58)63-53-21-11-8-18-45(53)48-34-41(24-28-56(48)63)60-32-31-57-51(37-60)46-19-9-12-22-54(46)61(57)40-15-5-2-6-16-40;1-5-16-47-39(12-1)40-13-2-6-17-48(40)55(47)37-22-26-53-45(31-37)46-32-38(23-27-54(46)58-53)56-49-18-7-3-14-41(49)43-29-35(20-24-50(43)56)33-10-9-11-34(28-33)36-21-25-52-44(30-36)42-15-4-8-19-51(42)57-52;1-2-10-33(11-3-1)34-18-23-49-42(28-34)39-12-4-7-15-47(39)55(49)37-21-26-53-45(31-37)46-32-38(22-27-54(46)58-53)56-48-16-8-5-13-40(48)43-29-35(19-24-50(43)56)36-20-25-52-44(30-36)41-14-6-9-17-51(41)57-52;1-6-16-41-33(11-1)34-12-2-7-17-42(34)49(41)30-21-24-46-38(27-30)37-15-5-10-20-45(37)51(46)32-23-26-48-40(29-32)39-28-31(22-25-47(39)52-48)50-43-18-8-3-13-35(43)36-14-4-9-19-44(36)50/h2*1-37H;2*1-32H;1-29H/q;+1;;;
InChIKeyWMMHXZLGRIFIEZ-UHFFFAOYSA-N
XLogP73.94
TPSA159.95 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds21
Heavy Atoms296
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003779.45
LogP ≤ 573.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium with MolForge

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Related Compounds

2-N-(4-fluorophenyl)-2-N,9-dimethyl-7-N-(8-methyldibenzofuran-2-yl)-7-N-phenylcarbazole-2,7-diamine
CID 23593191
2-N,9-dimethyl-7-N-(8-methyldibenzofuran-2-yl)-7-N-phenyl-2-N-[4-(trifluoromethyl)phenyl]carbazole-2,7-diamine
CID 23593276
9-(8-Fluorodibenzofuran-2-yl)-3-[9-(8-fluorodibenzofuran-2-yl)carbazol-3-yl]carbazole
CID 58511053
3-[9-Dibenzofuran-2-yl-6-(6-fluoro-9-phenylcarbazol-3-yl)carbazol-3-yl]-6-fluoro-9-phenylcarbazole
CID 68112373
3,6-Di(carbazol-9-yl)-9-(8-fluorodibenzofuran-2-yl)carbazole
CID 89505208
4-phenyl-N-(4-phenylphenyl)-N-[4-[9-[8-(trifluoromethyl)dibenzofuran-2-yl]carbazol-3-yl]phenyl]aniline
CID 90321207
9-[8-(9-Fluorodibenzofuran-2-yl)dibenzofuran-2-yl]carbazole
CID 121420191
9-(8-Carbazol-9-yldibenzofuran-2-yl)-3-dibenzofuran-2-yl-6-(trifluoromethyl)carbazole
CID 134343512
3-Dibenzofuran-2-yl-9-(2,3-dimethyl-1-benzofuran-5-yl)-6-(trifluoromethyl)carbazole
CID 134343629
3-(8-Carbazol-9-yldibenzofuran-4-yl)-9-dibenzofuran-2-yl-6-(trifluoromethyl)carbazole
CID 134343652
3-[9-Dibenzofuran-2-yl-6-[6-(4-fluorophenyl)-9-phenylcarbazol-3-yl]carbazol-3-yl]-6-(4-fluorophenyl)-9-phenylcarbazole
CID 137420869
N-dibenzofuran-2-yl-N-[9-(4-fluorophenyl)carbazol-3-yl]-9-phenylcarbazol-2-amine
CID 138548940

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium?
The IUPAC name of 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium (CID 159280259) is 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium.
What is the SMILES notation for 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium?
The canonical SMILES for 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium is c1cc(-c2ccc3oc4ccccc4c3c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-[n+]7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)cc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)cc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6cc(-c7cccc(-n8c9ccccc9c9ccccc98)c7)ccc65)cc4c3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3c2c1.
What is the InChIKey of 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium?
The InChIKey is WMMHXZLGRIFIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H37N3O.C59H37N4O.2C54H32N2O2.C48H29N3O/c1-2-13-38(14-3-1)40-25-29-57-49(34-40)47-19-6-10-23-55(47)62(57)43-27-31-59-51(36-43)52-37-44(28-32-60(52)64-59)63-56-24-11-7-20-48(56)50-35-41(26-30-58(50)63)39-15-12-16-42(33-39)61-53-21-8-4-17-45(53)46-18-5-9-22-54(46)61;1-3-13-38(14-4-1)39-23-27-55-47(33-39)44-17-7-10-20-52(44)62(55)42-25-29-58-49(35-42)50-36-43(26-30-59(50)64-58)63-53-21-11-8-18-45(53)48-34-41(24-28-56(48)63)60-32-31-57-51(37-60)46-19-9-12-22-54(46)61(57)40-15-5-2-6-16-40;1-5-16-47-39(12-1)40-13-2-6-17-48(40)55(47)37-22-26-53-45(31-37)46-32-38(23-27-54(46)58-53)56-49-18-7-3-14-41(49)43-29-35(20-24-50(43)56)33-10-9-11-34(28-33)36-21-25-52-44(30-36)42-15-4-8-19-51(42)57-52;1-2-10-33(11-3-1)34-18-23-49-42(28-34)39-12-4-7-15-47(39)55(49)37-21-26-53-45(31-37)46-32-38(22-27-54(46)58-53)56-48-16-8-5-13-40(48)43-29-35(19-24-50(43)56)36-20-25-52-44(30-36)41-14-6-9-17-51(41)57-52;1-6-16-41-33(11-1)34-12-2-7-17-42(34)49(41)30-21-24-46-38(27-30)37-15-5-10-20-45(37)51(46)32-23-26-48-40(29-32)39-28-31(22-25-47(39)52-48)50-43-18-8-3-13-35(43)36-14-4-9-19-44(36)50/h2*1-37H;2*1-32H;1-29H/q;+1;;;.
What are the key properties of 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium?
3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium has a molecular weight of 3779.45 g/mol, XLogP of 73.94, 21 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-(3-dibenzofuran-2-ylphenyl)carbazole;3-(3-carbazol-9-ylphenyl)-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole;5-phenyl-2-[9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazol-3-yl]pyrido[4,3-b]indol-2-ium is sourced from PubChem (CID 159280259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).