1,4-Pregnadien-11-beta, 17,21-Triol-3,20-Dione 17-Valerate-21-Acetate
[CAS# 15180-00-4]

Identification

• Name: 1,4-Pregnadien-11-beta, 17,21-Triol-3,20-Dione 17-Valerate-21-Acetate
• Synonyms: Pentanoic Acid [11-Hydroxy-17-(2-Hydroxy-1-Oxoethyl)-10,13-Dimethyl-3-Oxo-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl] Ester; Valeric Acid (17-Glycoloyl-11-Hydroxy-3-Keto-10,13-Dimethyl-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl) Ester; [11-Hydroxy-17-(2-Hydroxyethanoyl)-10,13-Dimethyl-3-Oxo-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl] Pentanoate
• Molecular Formula: C₂₆H₃₆O₆
• Molecular Weight: 444.57
• CAS Registry Number: 15180-00-4
• EINECS: 239-228-2
• SMILES: C(C)CCC(=O)OC3(CCC4C2CCC1=CC(=O)C=CC1(C)C2C(O)CC34C)C(=O)CO
• InChI: 1S/C26H36O6/c1-4-5-6-22(31)32-26(21(30)15-27)12-10-19-18-8-7-16-13-17(28)9-11-24(16,2)23(18)20(29)14-25(19,26)3/h9,11,13,18-20,23,27,29H,4-8,10,12,14-15H2,1-3H3
• InChIKey: BOFKYYWJAOZDPB-UHFFFAOYSA-N

Properties

• Density: 1.232g/cm³ (Cal.)
• Boiling point: 597.554°C at 760 mmHg (Cal.)
• Flash point: 196.811°C (Cal.)