NSC76982
Molecular Formula:
C25H37NO3S
InChI: InChI=1/C25H37NO3S/c1-5-6-15-30-23(28)25(4)13-10-21-20(22(25)11-14-26)8-7-18-16-19(29-17(2)27)9-12-24(18,21)3/h7,19-22H,5-6,8-13,15-16H2,1-4H3/t19-,20+,21-,22-,24-,25-/m0/s1
InChIKey: InChIKey=JFFSTLYNUSZJBJ-JMTDQOONBQ
SMILES: CCCCSC(=O)C1(CCC2C(C1CC#N)CC=C3C2(CCC(C3)OC(=O)C)C)C
Names:
NSC76982
[(2S,4aR,4bS,7S,8S,8aR)-7-butylsulfanylcarbonyl-8-(cyanomethyl)-4a,7-dimethyl-1,2,3,4,4b,5,6,8,8a,9-decahydrophenanthren-2-yl] acetate
Registries:
PubChem CID 253754
PubChem ID 118009
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