(3S,3'R,3'aS,6'S,6aS,6bS,7'aR,10R,10aS,11R,11aS,11bR)-3',6',10,11b-Tetramethylspiro[2,3,4,6,6a,6b,7,8,10,10a,11,11a-Dodecahydro-1H-Benzo[i]Fluorene-9,2'-3a,4,5,6,7,7a-Hexahydro-3H-Furo[4,5-b]Pyridine]-3,11-Diol
[CAS# 73825-59-9]

Identification

• Name: (3S,3'R,3'aS,6'S,6aS,6bS,7'aR,10R,10aS,11R,11aS,11bR)-3',6',10,11b-Tetramethylspiro[2,3,4,6,6a,6b,7,8,10,10a,11,11a-Dodecahydro-1H-Benzo[i]Fluorene-9,2'-3a,4,5,6,7,7a-Hexahydro-3H-Furo[4,5-b]Pyridine]-3,11-Diol
• Synonyms: 11-Deoxo-12-Beta,13-Alpha-Dihydro-11-Alpha-Hydroxyjervine; 12-Beta,13-Alpha-Dihydrojervine-11-Alpha-Ol; Jervine, 11-Deoxo-12-Beta,13-Alpha-Dihydro-11-Alpha-Hydroxy-
• Molecular Formula: C₂₇H₄₃NO₃
• Molecular Weight: 429.64
• CAS Registry Number: 73825-59-9
• SMILES: [C@@H]16[C@H]([C@H]2[C@H]([C@@H]1O)[C@@]3(C(=CC2)C[C@@H](O)CC3)C)CCC5(O[C@H]4[C@@H](NC[C@H](C4)C)[C@H]5C)[C@@H]6C
• InChI: 1S/C27H43NO3/c1-14-11-21-24(28-13-14)16(3)27(31-21)10-8-19-20-6-5-17-12-18(29)7-9-26(17,4)23(20)25(30)22(19)15(27)2/h5,14-16,18-25,28-30H,6-13H2,1-4H3/t14-,15+,16+,18-,19-,20-,21+,22+,23+,24-,25+,26-,27?/m0/s1
• InChIKey: SVAVMAWBMZEVEB-QIUZIFNTSA-N

Properties

• Density: 1.171g/cm³ (Cal.)
• Boiling point: 577.39°C at 760 mmHg (Cal.)
• Flash point: 302.995°C (Cal.)