[(3S,8R,9S,10R,13S,14S,17R)-17-Acetyl-17-Hydroxy-10,13-Dimethyl-16-Methylene-2,3,4,7,8,9,11,12,14,15-Decahydro-1H-Cyclopenta[a]Phenanthren-3-Yl] Acetate
[CAS# 15369-66-1]

Identification

• Name: [(3S,8R,9S,10R,13S,14S,17R)-17-Acetyl-17-Hydroxy-10,13-Dimethyl-16-Methylene-2,3,4,7,8,9,11,12,14,15-Decahydro-1H-Cyclopenta[a]Phenanthren-3-Yl] Acetate
• Synonyms: (1S,5S,11S,15S,2R,10R,14R)-14-acetyl-14-hydroxy-2,15-dimethyl-13-methylenetetracyclo[8.7.0.0<2,7>.0<11,15>]heptadec-7-en-5-yl acetate; 16-Methylene-17α-hydroxypregnenolone 3-acetate
• Molecular Formula: C₂₄H₃₄O₄
• Molecular Weight: 386.52
• CAS Registry Number: 15369-66-1
• SMILES: O=C(O[C@@H]4C/C3=C/C[C@@H]1[C@H](CC[C@@]2([C@](O)(C(=C)\C[C@@H]12)C(=O)C)C)[C@@]3(C)CC4)C
• InChI: 1S/C24H34O4/c1-14-12-21-19-7-6-17-13-18(28-16(3)26)8-10-22(17,4)20(19)9-11-23(21,5)24(14,27)15(2)25/h6,18-21,27H,1,7-13H2,2-5H3/t18-,19+,20-,21-,22-,23-,24-/m0/s1
• InChIKey: JTJUKIHKTIFJBL-IWMXCVPLSA-N

Properties

• Density: 1.14g/cm³ (Cal.)
• Boiling point: 497.5°C at 760 mmHg (Cal.)
• Flash point: 163.4°C (Cal.)
• Refractive index: 1.553 (Cal.)