Analyte Name

Potassium 3-((7R,8R,9S,10R,13S,14S,17S)-17-Hydroxy-10,13-dimethyl-7-(methylthio)-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoate

Molecular Formula

C23 H33 O4 S . K

Molecular Weight

444.669

Accurate Mass

444.174

SMILES

[K+].CS[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@]4(O)CCC(=O)[O-])[C@H]13

InChI

InChI=1S/C23H34O4S.K/c1-21-8-4-15(24)12-14(21)13-18(28-3)20-16(21)5-9-22(2)17(20)6-10-23(22,27)11-7-19(25)26;/h12,16-18,20,27H,4-11,13H2,1-3H3,(H,25,26);/q;+1/p-1/t16-,17-,18+,20+,21-,22-,23-;/m0./s1

IUPAC

potassium;3-[(7R,8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-7-methylsulfanyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive small molecule

Product Format

Neat