methyl (4S,5R,9R,10R,13R,17S)-4-hydroxy-13-methyl-17-(4-nitrobenzoyl)oxy-1-oxo-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carboxylate
Molecular Formula:
C27H31NO8
InChI: InChI=1/C27H31NO8/c1-26-14-13-19-17(7-8-20-21(29)10-11-22(30)27(19,20)25(32)35-2)18(26)9-12-23(26)36-24(31)15-3-5-16(6-4-15)28(33)34/h3-6,19-21,23,29H,7-14H2,1-2H3/t19-,20+,21-,23-,26-,27-/m0/s1
InChIKey: InChIKey=APXYYHVQYSPMEZ-SYCZMHKTBD
SMILES: CC12CCC3C(=C1CCC2OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])CCC5C3(C(=O)CCC5O)C(=O)OC
Names:
methyl (4S,5R,9R,10R,13R,17S)-4-hydroxy-13-methyl-17-(4-nitrobenzoyl)oxy-1-oxo-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carboxylate
Registries:
PubChem CID 10951159
PubChem ID 16004851
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