4-[2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-17-Yl]-2-Oxoethoxy]-4-Oxobutanoic Acid
[CAS# 10215-74-4]

Identification

• Name: 4-[2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-17-Yl]-2-Oxoethoxy]-4-Oxobutanoic Acid
• Synonyms: 4-[2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethoxy]-4-Oxo-Butanoic Acid; 4-Keto-4-[2-Keto-2-[(8S,9S,10R,13S,14S,17S)-3-Keto-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl]Ethoxy]Butyric Acid; 21-Hydroxyprogesterone 21-Hemisuccinate
• Molecular Formula: C₂₅H₃₄O₆
• Molecular Weight: 430.54
• CAS Registry Number: 10215-74-4
• EINECS: 233-528-7
• SMILES: [C@H]24[C@H]1[C@@]([C@H](CC1)C(=O)COC(=O)CCC(=O)O)(CC[C@@H]2[C@@]3(C(=CC(=O)CC3)CC4)C)C
• InChI: 1S/C25H34O6/c1-24-11-9-16(26)13-15(24)3-4-17-18-5-6-20(25(18,2)12-10-19(17)24)21(27)14-31-23(30)8-7-22(28)29/h13,17-20H,3-12,14H2,1-2H3,(H,28,29)/t17-,18-,19-,20+,24-,25-/m0/s1
• InChIKey: CYWICJWKZPXJSA-PQWRYPMOSA-N

Properties

• Density: 1.228g/cm³ (Cal.)
• Boiling point: 613.215°C at 760 mmHg (Cal.)
• Flash point: 205.744°C (Cal.)