Chem
J-GLOBAL ID：200907017532465370   Nikkaji number：J2.524.918F

Hodgkinsine B

ホドグキンシンB
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C33H38N6
Molecular formula furigana： C33-H38-N6
Molecular weight： 518.708
InChI： InChI=1S/C33H38N6/c1-37-18-15-31(21-9-4-6-13-25(21)34-28(31)37)23-11-8-12-24-27(23)36-30-33(24,17-20-39(30)3)32-16-19-38(2)29(32)35-26-14-7-5-10-22(26)32/h4-14,28-30,34-36H,15-20H2,1-3H3/t28-,29+,30-,31+,32-,33+/m0/s1
InChI key： DPVWJPVYOXKFRQ-AEAWEUCCSA-N
SMILES： CN1CC[C@]2([C@H]1Nc1ccccc21)c1cccc2c1N[C@H]1N(C)CC[C@@]21[C@]12CCN(C)[C@H]1Nc1ccccc21
Systematic name  (3)：
  • (3aR,3′aS,3′′aR,8aR,8′aS,8′′aS)-2,2′,2′′,3,3′,3′′,8,8′,8′′,8a,8′a,8′′a-ドデカヒドロ-1,1′,1′′-トリメチル-3a,3′a(1H,1′H):7′,3′′a(1′′H)-テル(ピロロ[2,3-b]インドール)
  • (3aS,8aS)-3a-[(3aR,8aR)-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール-3a-イル]-7-[(3aR,8aS)-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール-3a-イル]-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール
  • (3aS,8aS)-3a-[(3aR,8aR)-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-3a-yl]-7-[(3aR,8aS)-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-3a-yl]-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indole
Other name (3)：
  • (3aR,3′aS,3′′aR,8aR,8′aS,8′′aS)-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)-ter(pyrrolo[2,3-b]indole)
  • Hodgkinsine B
  • ホドグキンシンB
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