(3alpha,5alpha,16alpha,17alpha)-Androstane-3,16,17-Triol
[CAS# 63230-55-7]

Identification

• Name: (3alpha,5alpha,16alpha,17alpha)-Androstane-3,16,17-Triol
• Synonyms: 5α-Androstan-3α,16α,17α-triol
• Molecular Formula: C₁₉H₃₂O₃
• Molecular Weight: 308.46
• CAS Registry Number: 63230-55-7
• SMILES: O[C@@H]4C[C@H]3[C@H]2[C@@H]([C@@]1([C@H](C[C@H](O)CC1)CC2)C)CC[C@]3(C)[C@@H]4O
• InChI: 1S/C19H32O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h11-17,20-22H,3-10H2,1-2H3/t11-,12+,13+,14-,15-,16+,17+,18-,19-/m0/s1
• InChIKey: CXGDRQWRJUSSAR-XKYJBRGQSA-N

Properties

• Density: 1.164g/cm³ (Cal.)
• Boiling point: 436.135°C at 760 mmHg (Cal.)
• Flash point: 196.435°C (Cal.)