3beta,17alpha,20alpha-Trihydroxy-5-pregnene
[CAS# 903-67-3]

Identification

• Name: 3beta,17alpha,20alpha-Trihydroxy-5-pregnene
• Synonyms: 5-Pregnene-3Beta,17Alpha,20Alpha-Triol; Pregn-5-Ene-3,17,20-Triol, (3Beta,20S)-; Pregn-5-Ene-3Beta,17Alpha,20Alpha-Triol
• Molecular Formula: C₂₁H₃₄O₃
• Molecular Weight: 334.50
• CAS Registry Number: 903-67-3
• SMILES: [C@@]14(C)[C@H]([C@H]2[C@H](CC1)[C@]3(C)C(=CC2)C[C@H](CC3)O)CC[C@@]4([C@H](C)O)O
• InChI: 1S/C21H34O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h4,13,15-18,22-24H,5-12H2,1-3H3/t13-,15-,16+,17-,18-,19-,20-,21-/m0/s1
• InChIKey: XGUQCUDPXSTKLI-PUOFRWEFSA-N

Properties

• Density: 1.16g/cm³ (Cal.)
• Boiling point: 482.659°C at 760 mmHg (Cal.)
• Flash point: 216.08°C (Cal.)