Longispinogenin
[CAS# 465-94-1]

Identification

• Name: Longispinogenin
• Synonyms: (3S,4Ar,6Ar,6Bs,8S,8Ar,12As,14Ar,14Br)-4,4,6A,6B,11,11,14B-Heptamethyl-8,8A-Dimethylol-1,2,3,4A,5,6,7,8,9,10,12,12A,14,14A-Tetradecahydropicen-3-Ol; (3S,4Ar,5R,6Ar,6Bs,8S,8Ar,12As,14Ar,14Br)-8,8A-Bis-Hydroxymethyl-4,4,6A,6B,11,11,14B-Heptamethyl-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,14,14A,14B-Eicosahydro-Picen-3-Ol; Aids-113414
• Molecular Formula: C₃₁H₅₂O₃
• Molecular Weight: 472.75
• CAS Registry Number: 465-94-1
• SMILES: [C@@]23([C@@H]([C@@]1([C@H](C([C@@H](O)CC1)(C)C)CC2)C)CC=C4[C@]3(C[C@@H]([C@@]5([C@H]4CC(CC5)(C)C)CO)CO)C)C
• InChI: 1S/C31H52O3/c1-26(2)14-15-31(19-33)20(18-32)16-30(7)21(22(31)17-26)8-9-24-28(5)12-11-25(34)27(3,4)23(28)10-13-29(24,30)6/h8,20,22-25,32-34H,9-19H2,1-7H3/t20-,22+,23+,24-,25+,28+,29-,30-,31+/m1/s1
• InChIKey: NGJUAJNTJXNCFH-VUTUYJMDSA-N

Properties

• Density: 1.094g/cm³ (Cal.)
• Boiling point: 561.897°C at 760 mmHg (Cal.)
• Flash point: 226.569°C (Cal.)