Description
3-p-Coumaroylquinic acid, a natural compound, can be isolated from sources such as Ribes uva-crispa and Prunus cerasus.
IUPAC Name: (1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
InChI: InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1
InChIKey: BMRSEYFENKXDIS-QHAYPTCMSA-N
SMILES: C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC=C(C=C2)O)O)O
Synonyms: 3-p-coumaroylquinic acid; 87099-71-6; 3-O-Coumaroylquinic acid; 5-O-Coumaroylquinic acid; 3-p-Coqa; 1AF7V9VW0S; (1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid; UNII-1AF7V9VW0S; …
Botanical Source: