[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4-pyren-1-ylbutanoate
Molecular Formula:
C47H60O2
InChI: InChI=1/C47H60O2/c1-30(2)9-6-10-31(3)40-23-24-41-39-22-20-36-29-37(25-27-46(36,4)42(39)26-28-47(40,41)5)49-43(48)14-8-11-32-15-16-35-18-17-33-12-7-13-34-19-21-38(32)45(35)44(33)34/h7,12-13,15-21,30-31,37,39-42H,6,8-11,14,22-29H2,1-5H3/t31-,37+,39+,40-,41+,42+,46+,47-/m1/s1
InChIKey: InChIKey=XYRDCRBGCDIMBH-ZMFSBRCCBA
SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CCCC5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)C)C
Names:
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4-pyren-1-ylbutanoate
Registries:
PubChem CID 192055
PubChem ID 10261367
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