CHEBI:144425 - trans-aconitic acid anhydride

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name trans-aconitic acid anhydride
ChEBI ID CHEBI:144425
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C6H4O5
Net Charge 0
Average Mass 156.093
Monoisotopic Mass 156.006
InChI InChI=1S/C6H4O5/c7-4-1-3(6(9)10)2-5(8)11-4/h1H,2H2,(H,9,10)
InChIKey UNCRKEZQEKKGQX-UHFFFAOYSA-N
SMILES O1C(=O)CC(=CC1=O)C(O)=O
Metabolite of Species Details
Hyacinthoides non-scripta (NCBI:txid81762) Found in bulb (BTO:0000159). of strain Hyacinthoides non-scripta (L.) Chouard ex. Rothm. See: MetaboLights Study
ChEBI Ontology
Outgoing trans-aconitic acid anhydride (CHEBI:144425) is a carbonyl compound (CHEBI:36586)
IUPAC Name
2,6-dioxo-3,6-dihydro-2H-pyran-4-carboxylic acid