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[(8R,9S,13S,14S,16R,17R)-3-methoxy-13-methyl-17-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl] 2-bromanylethanoate
[(8R,9S,13S,14S,16R,17R)-3-methoxy-13-methyl-17-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl] 2-bromanylethanoate
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Canonical SMILES:
CC12CCC3C(C1CC(C2O)OC(=O)CBr)CCC4=C3C=CC(=C4)OC
Isomeric SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)OC(=O)CBr)CCC4=C3C=CC(=C4)OC
InChI
InChI=1S/C21H27BrO4/c1-21-8-7-15-14-6-4-13(25-2)9-12(14)3-5-16(15)17(21)10-18(20(21)24)26-19(23)11-22/h4,6,9,15-18,20,24H,3,5,7-8,10-11H2,1-2H3/t15-,16-,17+,18-,20+,21+/m1/s1
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