17-(acetyloxy)-3-methoxy-20-oxo-Pregna-3,5-diene-6-carboxaldehyde
[CAS# 57361-81-6]

Identification

• Name: 17-(acetyloxy)-3-methoxy-20-oxo-Pregna-3,5-diene-6-carboxaldehyde
• Synonyms: Acetic Acid [(8R,9S,10R,13S,14S,17R)-17-Acetyl-6-Formyl-3-Methoxy-10,13-Dimethyl-1,2,7,8,9,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl] Ester; [(8R,9S,10R,13S,14S,17R)-17-Ethanoyl-6-Methanoyl-3-Methoxy-10,13-Dimethyl-1,2,7,8,9,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl] Ethanoate; 3-Methoxy-6-Formyl-3,5-Pregnadien-17-Acetate-20-One-Oxyma
• Molecular Formula: C₂₅H₃₄O₅
• Molecular Weight: 414.54
• CAS Registry Number: 57361-81-6
• SMILES: [C@@H]23CC(=C1C=C(CC[C@@]1([C@H]2CC[C@]4([C@H]3CC[C@@]4(C(C)=O)OC(=O)C)C)C)OC)C=O
• InChI: 1S/C25H34O5/c1-15(27)25(30-16(2)28)11-8-21-19-12-17(14-26)22-13-18(29-5)6-9-23(22,3)20(19)7-10-24(21,25)4/h13-14,19-21H,6-12H2,1-5H3/t19-,20+,21+,23-,24+,25+/m1/s1
• InChIKey: KPFBUSLHFFWMAI-HYRPPVSQSA-N

Properties

• Density: 1.166g/cm³ (Cal.)
• Boiling point: 546.901°C at 760 mmHg (Cal.)
• Flash point: 234.689°C (Cal.)