Description
5-O-Caffeoylshikimic acid is a compound found in the fruits of *Illicium verum*.
IUPAC Name: (3R,4R,5R)-5-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4-dihydroxycyclohexene-1-carboxylic acid
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/h1-6,12-13,15,17-19,21H,7H2,(H,22,23)/b4-2+/t12-,13-,15-/m1/s1
InChIKey: QMPHZIPNNJOWQI-GDDAOPKQSA-N
SMILES: C1[C@H]([C@@H]([C@@H](C=C1C(=O)O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O
Synonyms: 5-O-Caffeoylshikimic acid; 73263-62-4; Dactylifric acid; 5-caffeoylshikimic acid; 5U399BD0RZ; (3R,4R,5R)-5-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4-dihydroxycyclohexene-1-carboxylic acid; 5-CSA; MEGxp0_000239; …
Botanical Source: