Diferulic acid
Molecular Formula:
C
20
H
18
O
8
InChI:
InChI=1/C20H18O8/c1-27-15-9-11(3-5-17(21)22)7-13(19(15)25)14-8-12(4-6-18(23)24)10-16(28-2)20(14)26/h3-10,25-26H,1-2H3,(H,21,22)(H,23,24)/b5-3+,6-4+/f/h21,23H
InChIKey:
InChIKey=LBQZVWQOPFFQJI-MWQPIDGXDF
SMILES:
COC1=C(C(=CC(=C1)C=CC(=O)O)C2=CC(=CC(=C2O)OC)C=CC(=O)O)O
Names:
C10446
Diferulic acid
(E)-3-[3-[5-[(E)-2-carboxyethenyl]-2-hydroxy-3-methoxy-phenyl]-4-hydroxy-5-methoxy-phenyl]prop-2-enoic acid
436-96-4
Registries:
PubChem CID 5281770
PubChem ID 12629