2-caffeoylisocitric acid
InChI: InChI=1/C15H14O10/c16-9-3-1-7(5-10(9)17)2-4-12(20)25-13(15(23)24)8(14(21)22)6-11(18)19/h1-5,8,13,16-17H,6H2,(H,18,19)(H,21,22)(H,23,24)/b4-2-
InChIKey: InChIKey=KYSQDMNDMYECNZ-RQOWECAXBV
SMILES: OC(=O)CC(C(OC(=O)\C=C/C1=CC(O)=C(O)C=C1)C(O)=O)C(O)=O
Names:
2-Caffeoylisocitrate
2-caffeoylisocitrate
2-caffeoylisocitric acid
Registries:
PubChem CID 5280552
ChEBI 16166
Kegg C02927
PubChem ID 5849
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