Analytenname

trans-3-O-Caffeoylshikimic Acid

CAS-Nummer

180981-12-8

Molekularformel

C16 H16 O8

Molekulargewicht

336.293

Genaue Masse

336.085

SMILES

O[C@@H]1CC(=C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)C(=O)O

InChI

InChI=1S/C16H16O8/c17-10-3-1-8(5-11(10)18)2-4-14(20)24-13-7-9(16(22)23)6-12(19)15(13)21/h1-5,7,12-13,15,17-19,21H,6H2,(H,22,23)/b4-2+/t12-,13-,15+/m1/s1

IUPAC

(3R,4S,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4,5-dihydroxycyclohexene-1-carboxylic acid

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Bioactive Small Molecule

Produktformat

Neat