CHEBI:3586 - Chelidonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Chelidonic acid
ChEBI ID CHEBI:3586
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C7H4O6
Net Charge 0
Average Mass 184.103
Monoisotopic Mass 184.00079
InChI InChI=1S/C7H4O6/c8-3-1-4(6(9)10)13-5(2-3)7(11)12/h1-2H,(H,9,10)(H,11,12)
InChIKey PBAYDYUZOSNJGU-UHFFFAOYSA-N
SMILES OC(=O)c1cc(=O)cc(o1)C(O)=O
ChEBI Ontology
Outgoing Chelidonic acid (CHEBI:3586) is a carbonyl compound (CHEBI:36586)
Chelidonic acid (CHEBI:3586) is a pyrans (CHEBI:26407)
Synonyms Sources
4-Oxo-4H-pyran-2,6-dicarboxylic acid KEGG COMPOUND
Chelidonic acid KEGG COMPOUND
Manual Xrefs Databases
C00001304 KNApSAcK
C08476 KEGG COMPOUND
View more database links
Registry Number Type Source
99-32-1 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014