2-O-Caffeoylglucarate
Molecular Formula:
C15H16O11
InChI: InChI=1/C15H16O11/c16-7-3-1-6(5-8(7)17)2-4-9(18)26-13(15(24)25)11(20)10(19)12(21)14(22)23/h1-5,10-13,16-17,19-21H,(H,22,23)(H,24,25)/b4-2+/f/h22,24H
InChIKey: InChIKey=OMIXKOJEIRRAJW-VGEGIJRGDW
SMILES: C1=CC(=C(C=C1C=CC(=O)OC(C(C(C(C(=O)O)O)O)O)C(=O)O)O)O
Names:
C03062
2-O-Caffeoylglucarate
2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxy-hexanedioic acid
Registries:
PubChem CID 5280565
PubChem ID 5962
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