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(8S,11R,13S,14S,17S)-17-[2-(4-ethanoylphenyl)ethynyl]-11-(3-methoxyphenyl)-13-methyl-17-oxidanyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
(8S,11R,13S,14S,17S)-17-[2-(4-ethanoylphenyl)ethynyl]-11-(3-methoxyphenyl)-13-methyl-17-oxidanyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)C1=CC=C(C=C1)C#CC2(CCC3C2(CC(C4=C5CCC(=O)C=C5CCC34)C6=CC(=CC=C6)OC)C)O
Isomeric SMILES
CC(=O)C1=CC=C(C=C1)C#C[C@@]2(CC[C@@H]3[C@@]2(C[C@@H](C4=C5CCC(=O)C=C5CC[C@@H]34)C6=CC(=CC=C6)OC)C)O
InChI
InChI=1S/C35H36O4/c1-22(36)24-9-7-23(8-10-24)15-17-35(38)18-16-32-30-13-11-26-19-27(37)12-14-29(26)33(30)31(21-34(32,35)2)25-5-4-6-28(20-25)39-3/h4-10,19-20,30-32,38H,11-14,16,18,21H2,1-3H3/t30-,31+,32-,34-,35-/m0/s1
Other Product
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