11beta,17-Dihydroxypregn-4-Ene-3,20-Dione 21-[(1-Benzyl-1H-Indazol-3-Yl)Oxy]Acetate
[CAS# 53716-43-1]

Identification

• Name: 11beta,17-Dihydroxypregn-4-Ene-3,20-Dione 21-[(1-Benzyl-1H-Indazol-3-Yl)Oxy]Acetate
• Synonyms: [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] 2-[1-(Phenylmethyl)Indazol-3-Yl]Oxyacetate; 2-[[1-(Phenylmethyl)-3-Indazolyl]Oxy]Acetic Acid [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; 2-[1-(Benzyl)Indazol-3-Yl]Oxyacetic Acid [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-3-Keto-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₃₇H₄₂N₂O₇
• Molecular Weight: 626.75
• CAS Registry Number: 53716-43-1
• EINECS: 258-710-3
• SMILES: [C@H]57[C@H]4[C@@]([C@](C(COC(COC2=N[N](CC1=CC=CC=C1)C3=C2C=CC=C3)=O)=O)(O)CC4)(C[C@@H]([C@@H]5[C@@]6(C(=CC(=O)CC6)CC7)C)O)C
• InChI: 1S/C37H42N2O7/c1-35-16-14-25(40)18-24(35)12-13-26-28-15-17-37(44,36(28,2)19-30(41)33(26)35)31(42)21-45-32(43)22-46-34-27-10-6-7-11-29(27)39(38-34)20-23-8-4-3-5-9-23/h3-11,18,26,28,30,33,41,44H,12-17,19-22H2,1-2H3/t26-,28-,30-,33+,35-,36-,37-/m0/s1
• InChIKey: DYVIEGCPUPGXOH-HGGPGNIHSA-N