Terminology Service for NFDI4Health
JSON

Chicoric acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_3594

Term info

Label

Chicoric acid

Synonyms
  • Chicoric acid
database cross reference
Subsets

2_STAR

charge

0

formula

C22H18O12

has obo namespace

chebi_ontology

has related synonym

dicaffeoyltartaric acid

id

CHEBI:3594

inchi

InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20-/m1/s1

inchikey

YDDGKXBLOXEEMN-IABMMNSOSA-N

mass

474.372

monoisotopicmass

474.07983

smiles

[C@H]([C@@H](OC(/C=C/C=1C=C(C(O)=CC1)O)=O)C(O)=O)(OC(/C=C/C=2C=C(C(O)=CC2)O)=O)C(O)=O