(3S,8R,9S,10R,13R,14S)-4,4,10,13,14-Pentamethyl-17-[(2R)-6-Methylhept-5-En-2-Yl]-2,3,7,8,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthren-3-Ol
[CAS# 121108-99-4]

Identification

• Name: (3S,8R,9S,10R,13R,14S)-4,4,10,13,14-Pentamethyl-17-[(2R)-6-Methylhept-5-En-2-Yl]-2,3,7,8,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthren-3-Ol
• Synonyms: (3S,8R,9S,10R,13R,14S)-17-[(1R)-1,5-Dimethylhex-4-Enyl]-4,4,10,13,14-Pentamethyl-2,3,7,8,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; 19(10-9Beta)Abeo-Lanosta-5(6),24-Dien-3Beta-Ol; Cucurbita-5,24-Dien-3-Ol
• Molecular Formula: C₃₀H₅₀O
• Molecular Weight: 426.72
• CAS Registry Number: 121108-99-4
• SMILES: [C@H]13[C@@H]([C@@]2(C(=CC1)C([C@@H](O)CC2)(C)C)C)CC[C@]4([C@]3(CCC4[C@@H](CCC=C(C)C)C)C)C
• InChI: 1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,13,21-24,26,31H,9,11-12,14-19H2,1-8H3/t21-,22?,23+,24-,26+,28-,29-,30+/m1/s1
• InChIKey: JPIRLIZZOSSGHC-ZESBWBIMSA-N

Properties

• Density: 0.986g/cm³ (Cal.)
• Boiling point: 499.403°C at 760 mmHg (Cal.)
• Flash point: 221.301°C (Cal.)