3beta,17-Dihydroxy-6alpha-Methylpregn-4-En-20-One 17-Acetate
[CAS# 57-16-9]

Identification

• Name: 3beta,17-Dihydroxy-6alpha-Methylpregn-4-En-20-One 17-Acetate
• Synonyms: Acetic Acid (17-Acetyl-3-Hydroxy-6,10,13-Trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-17-Yl) Ester; (17-Ethanoyl-3-Hydroxy-6,10,13-Trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-17-Yl) Ethanoate; Nsc86014
• Molecular Formula: C₂₄H₃₆O₄
• Molecular Weight: 388.55
• CAS Registry Number: 57-16-9
• SMILES: CC34C(C2C(C1(C(=CC(O)CC1)C(C2)C)C)CC3)CCC4(OC(=O)C)C(=O)C
• InChI: 1S/C24H36O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h13-14,17-20,27H,6-12H2,1-5H3
• InChIKey: ODVZWAWQENIRKD-UHFFFAOYSA-N

Properties

• Density: 1.136g/cm³ (Cal.)
• Boiling point: 494.524°C at 760 mmHg (Cal.)
• Flash point: 161.274°C (Cal.)