Hodgkinsine
3-methyl-5,8b-bis(3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole
Also Known As: Hodgkinsine|hodgkinsine B|Pyrrolo[2,3-b]indole, hodgkinsine deriv.|J3.153.913G|3-methyl-5,8b-bis(3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole|3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1''-trimethyl-|3a,3a :7 ,3a -Ter(1-methyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole)|1-methyl-3a,7-bis({1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-3a-yl})-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indole|Stereoisomer of 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1''-trimethyl-3a,3'a(1H,1'H):7',3''a(1''H)-terpyrrolo[2,3-b]indole
| Molecular Formula | C33H38N6 |
|---|---|
| Molecular Weight | 518.3158 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 518.3158 |
| Monoisotopic Mass | 518.3158 |
| Heavy Atoms | 39 |
| Complexity | 989.0 |
Chemical Identifiers
| CAS Number | 586955-76-2 |
|---|---|
| SMILES | CN1CCC2(C1NC3=CC=CC=C32)C4=C5C(=CC=C4)C6(CCN(C6N5)C)C78CCN(C7NC9=CC=CC=C89)C |
| InChIKey | DPVWJPVYOXKFRQ-UHFFFAOYSA-N |
Product Overview
Hodgkinsine (CAS 586955-76-2), with molecular formula C33H38N6 and molecular weight 518.3158 g/mol. IUPAC: 3-methyl-5,8b-bis(3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole.
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