(2S,3S,4S,5R,6R)-6-(N-Ethyl-2-isopropyl-5-methylcyclohexane-1-carboxamido)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic Acid

Analyte Name

(2S,3S,4S,5R,6R)-6-(N-Ethyl-2-isopropyl-5-methylcyclohexane-1-carboxamido)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic Acid

Molecular Formula

C19 H33 N O7

Molecular Weight

387.468

Accurate Mass

387.226

SMILES

CCN([C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O)C(=O)C2CC(C)CCC2C(C)C

InChI

InChI=1S/C19H33NO7/c1-5-20(17(24)12-8-10(4)6-7-11(12)9(2)3)18-15(23)13(21)14(22)16(27-18)19(25)26/h9-16,18,21-23H,5-8H2,1-4H3,(H,25,26)/t10?,11?,12?,13-,14-,15+,16-,18+/m0/s1

IUPAC

(2S,3S,4S,5R,6R)-6-[ethyl-(5-methyl-2-propan-2-ylcyclohexanecarbonyl)amino]-3,4,5-trihydroxyoxane-2-carboxylic acid

Country of Origin

CANADA

Product Format

Neat