NSC3878

Molecular Formula: C35H58N2O5S2


InChI: InChI=1/C28H50N2O2S.C7H8O3S/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(33-25(29)30)28(32)16-19(31)11-14-27(28,5)23(20)12-13-26(21,22)4;1-6-2-4-7(5-3-6)11(8,9)10/h17-24,31-32H,6-16H2,1-5H3,(H3,29,30);2-5H,1H3,(H,8,9,10)/f/h29H,30H2;8H/b29-25+;

InChIKey: InChIKey=FVGSQMAYFJUBNB-JFVJIWSLDM
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)SC(=N)N)C

Names:
    NSC3878
    [3,5-dihydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-yl]sulfanylmethanimidamide; 4-methylbenzenesulfonic acid

Registries:
    PubChem CID 220729
    PubChem ID 70300