(20E)-3beta-Hydroxypregna-5,16-Dien-20-One 20-Oxime 3-Acetate
[CAS# 23549-24-8]

Identification

• Name: (20E)-3beta-Hydroxypregna-5,16-Dien-20-One 20-Oxime 3-Acetate
• Synonyms: [17-(N-Hydroxy-C-Methyl-Carbonimidoyl)-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Acetate; Acetic Acid [17-(1-Hydroxyiminoethyl)-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [17-[(1E)-1-Hydroxyiminoethyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester
• Molecular Formula: C₂₃H₃₃NO₃
• Molecular Weight: 371.52
• CAS Registry Number: 23549-24-8
• EINECS: 245-726-0
• SMILES: CC12CCC(CC1=CCC3C2CCC4(C3CC=C4C(=N/O)/C)C)OC(=O)C
• InChI: 1S/C23H33NO3/c1-14(24-26)19-7-8-20-18-6-5-16-13-17(27-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21,26H,6,8-13H2,1-4H3/b24-14+
• InChIKey: OVKSHCIVDWZSJD-ZVHZXABRSA-N

Properties

• Density: 1.232g/cm³ (Cal.)
• Boiling point: 495.002°C at 760 mmHg (Cal.)
• Flash point: 253.168°C (Cal.)