(3S,13R)-1,2,3,4,4aalpha,5,11,11aalpha-Octahydro-2,2,5-Trimethyl-3beta,5beta-Ethano-10bH-Pyrido[3,2-b]Carbazole-10bbeta,13-Diol
[CAS# 66833-16-7]

Identification

• Name: (3S,13R)-1,2,3,4,4aalpha,5,11,11aalpha-Octahydro-2,2,5-Trimethyl-3beta,5beta-Ethano-10bH-Pyrido[3,2-b]Carbazole-10bbeta,13-Diol
• Synonyms: Nsc286327; 3,5-Ethano-10Bh-Pyrido[3,2-B]Carbazole-10B,13-Diol, 1,2,3,4,4A,5,11,11A-Octahydro-2,2,5-Trimethyl-, [3S-(3.Alpha.,4A.Beta.,5.Alpha.,10B.Alpha.,11A.Beta.,13S*)]-; Aristotelinine B668273k009
• Molecular Formula: C₂₀H₂₆N₂O₂
• Molecular Weight: 326.44
• CAS Registry Number: 66833-16-7
• SMILES: C1=CC=CC5=C1C4(O)CC2NC(C3CC2C(CC3O)(C4=N5)C)(C)C
• InChI: 1S/C20H26N2O2/c1-18(2)13-8-12-15(22-18)9-20(24)11-6-4-5-7-14(11)21-17(20)19(12,3)10-16(13)23/h4-7,12-13,15-16,22-24H,8-10H2,1-3H3
• InChIKey: JZECANPAOKDOSF-UHFFFAOYSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 493.378°C at 760 mmHg (Cal.)
• Flash point: 252.186°C (Cal.)