trans-5-O-(4-Coumaroyl)-D-quinate
Molecular Formula:
C16H18O8
InChI: InChI=1/C16H18O8/c17-11-7-16(23,15(21)22)8-12(14(11)20)24-10-4-1-9(2-5-10)3-6-13(18)19/h1-6,11-12,14,17,20,23H,7-8H2,(H,18,19)(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1/f/h18,21H
InChIKey: InChIKey=NPYOLFDOJUMELJ-CXPITYTCDO
SMILES: C1C(C(C(CC1(C(=O)O)O)OC2=CC=C(C=C2)C=CC(=O)O)O)O
Names:
C04222
trans-5-O-(4-Coumaroyl)-D-quinate
(1R,3R,4S,5R)-3-[4-[(E)-2-carboxyethenyl]phenoxy]-1,4,5-trihydroxy-cyclohexane-1-carboxylic acid
Registries:
PubChem CID 5280661
PubChem ID 6894
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