3beta,17-Dihydroxy-16alpha-Methylpregn-5-En-20-One
[CAS# 4927-26-8]

Identification

• Name: 3beta,17-Dihydroxy-16alpha-Methylpregn-5-En-20-One
• Synonyms: Bb_Nc-0288; 3Beta,17-Dihydroxy-16Alpha-Methylpregn-5-En-20-One
• Molecular Formula: C₂₂H₃₄O₃
• Molecular Weight: 346.51
• CAS Registry Number: 4927-26-8
• EINECS: 225-557-9
• SMILES: [C@H]34[C@H]1[C@@H]([C@@]2(C(=CC1)C[C@@H](O)CC2)C)CC[C@@]3([C@](O)([C@@H](C4)C)C(=O)C)C
• InChI: 1S/C22H34O3/c1-13-11-19-17-6-5-15-12-16(24)7-9-20(15,3)18(17)8-10-21(19,4)22(13,25)14(2)23/h5,13,16-19,24-25H,6-12H2,1-4H3/t13-,16+,17-,18+,19+,20+,21+,22+/m1/s1
• InChIKey: MDCCMZGGNCMFPQ-HQURQYGRSA-N

Properties

• Density: 1.14g/cm³ (Cal.)
• Boiling point: 483.917°C at 760 mmHg (Cal.)
• Flash point: 260.57°C (Cal.)