Isoprednidene
[CAS# 17332-61-5]

Identification

• Name: Isoprednidene
• Synonyms: (17R)-11,17-Dihydroxy-17-(2-Hydroxyacetyl)-10,13-Dimethyl-16-Methylene-1,2,8,9,11,12,14,15-Octahydrocyclopenta[A]Phenanthren-3-One; (17R)-11,17-Dihydroxy-17-(2-Hydroxy-1-Oxoethyl)-10,13-Dimethyl-16-Methylene-1,2,8,9,11,12,14,15-Octahydrocyclopenta[A]Phenanthren-3-One; (17R)-17-Glycoloyl-11,17-Dihydroxy-10,13-Dimethyl-16-Methylene-1,2,8,9,11,12,14,15-Octahydrocyclopenta[A]Phenanthren-3-One
• Molecular Formula: C₂₂H₂₈O₅
• Molecular Weight: 372.46
• CAS Registry Number: 17332-61-5
• SMILES: [C@@]4(O)(C3(C(C2C(C1(C(=CC(=O)CC1)C=C2)C)C(O)C3)CC4=C)C)C(=O)CO
• InChI: 1S/C22H28O5/c1-12-8-16-15-5-4-13-9-14(24)6-7-20(13,2)19(15)17(25)10-21(16,3)22(12,27)18(26)11-23/h4-5,9,15-17,19,23,25,27H,1,6-8,10-11H2,2-3H3/t15?,16?,17?,19?,20?,21?,22-/m0/s1
• InChIKey: MAAGHJOYEMWLNT-ODZMLSBPSA-N

Properties

• Density: 1.302g/cm³ (Cal.)
• Boiling point: 596.077°C at 760 mmHg (Cal.)
• Flash point: 328.326°C (Cal.)