Ethyl (3beta-Acetoxy-17-Azido-16alpha-Hydroxypregn-5-En-20-Ylidene)Carbazate
[CAS# 63973-99-9]

Identification

• Name: Ethyl (3beta-Acetoxy-17-Azido-16alpha-Hydroxypregn-5-En-20-Ylidene)Carbazate
• Synonyms: [(3S,10R,13S,16R,17R)-17-Azido-17-[N-(Ethoxycarbonylamino)-C-Methyl-Carbonimidoyl]-16-Hydroxy-10,13-Dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-3-Yl] Acetate; Acetic Acid [(3S,10R,13S,16R,17R)-17-Azido-17-[(1E)-1-(Ethoxycarbonylhydrazono)Ethyl]-16-Hydroxy-10,13-Dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [(3S,10R,13S,16R,17R)-17-Azido-17-[N-(Carbethoxyamino)-C-Methyl-Carbonimidoyl]-16-Hydroxy-10,13-Dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-3-Yl] Ester
• Molecular Formula: C₂₆H₃₉N₅O₅
• Molecular Weight: 501.62
• CAS Registry Number: 63973-99-9
• EINECS: 264-586-1
• SMILES: [N+](=N[C@]4([C@@]3(C(C1C([C@@]2(C(=CC1)C[C@@H](OC(=O)C)CC2)C)CC3)C[C@H]4O)C)/C(=N/NC(OCC)=O)C)=[N-]
• InChI: 1S/C26H39N5O5/c1-6-35-23(34)29-28-15(2)26(30-31-27)22(33)14-21-19-8-7-17-13-18(36-16(3)32)9-11-24(17,4)20(19)10-12-25(21,26)5/h7,18-22,33H,6,8-14H2,1-5H3,(H,29,34)/b28-15+/t18-,19?,20?,21?,22+,24-,25-,26+/m0/s1
• InChIKey: MCZQQHKOLGEDPS-XSQZIVNASA-N