NSC5008

Molecular Formula: C24H41NO4


InChI: InChI=1/C20H30O2.C4H11NO2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;1-4(5,2-6)3-7/h12,16-17H,5-11H2,1-4H3,(H,21,22);6-7H,2-3,5H2,1H3/f/h21H;

InChIKey: InChIKey=BETBCNVDXAOPIB-IYBBYDNFCD
SMILES: CC(=C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C.CC(CO)(CO)N

Names:
    NSC5008
    1,3-Propanediol, 2-amino-2-methyl, salt with 1 f. wt. neoabietic acid
    1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid; 2-amino-2-methyl-propane-1,3-diol
    1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10, 10a-dodecahydro-1,4a-dimethyl-7- (1-methylethylidene)-, [1R-(1.alpha.,4a.beta.,4b.alpha.,10a.alpha.)]-, compd. with 2-amino-2-methyl-1,3-propanediol (1:1)
    5401-89-8

Registries:
    PubChem CID 221119
    PubChem ID 71193