[(9R)-5,8,9-Trihydroxy-5-Methyl-9-[(9R,10R,13R,17S)-2,3,14-Trihydroxy-10,13-Dimethyl-6-Oxo-2,3,4,5,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]Decyl] 2-Bromoacetate
[CAS# 123171-56-2]

Identification

• Name: [(9R)-5,8,9-Trihydroxy-5-Methyl-9-[(9R,10R,13R,17S)-2,3,14-Trihydroxy-10,13-Dimethyl-6-Oxo-2,3,4,5,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]Decyl] 2-Bromoacetate
• Synonyms: 2-Bromoacetic Acid [(9R)-5,8,9-Trihydroxy-5-Methyl-9-[(9R,10R,13R,17S)-2,3,14-Trihydroxy-10,13-Dimethyl-6-Oxo-2,3,4,5,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Decyl] Ester; 2-Bromoacetic Acid [(9R)-5,8,9-Trihydroxy-5-Methyl-9-[(9R,10R,13R,17S)-2,3,14-Trihydroxy-6-Keto-10,13-Dimethyl-2,3,4,5,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Decyl] Ester; [(9R)-5,8,9-Trihydroxy-5-Methyl-9-[(9R,10R,13R,17S)-2,3,14-Trihydroxy-10,13-Dimethyl-6-Oxo-2,3,4,5,9,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Decyl] 2-Bromoethanoate
• Molecular Formula: C₃₂H₅₁BrO₉
• Molecular Weight: 659.65
• CAS Registry Number: 123171-56-2
• SMILES: [C@]24(C(O)(C1=CC(=O)C3[C@@]([C@H]1CC2)(CC(O)C(O)C3)C)CC[C@@H]4[C@@](O)(C(O)CCC(O)(CCCCOC(=O)CBr)C)C)C
• InChI: 1S/C32H51BrO9/c1-28(39,10-5-6-14-42-27(38)18-33)11-9-26(37)31(4,40)25-8-13-32(41)20-15-22(34)21-16-23(35)24(36)17-29(21,2)19(20)7-12-30(25,32)3/h15,19,21,23-26,35-37,39-41H,5-14,16-18H2,1-4H3/t19-,21?,23?,24?,25-,26?,28?,29+,30+,31+,32?/m0/s1
• InChIKey: MKOAYSNIIVISQK-ISCISVNWSA-N