CHEBI:200669 - Redoxcitrinin

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 Redoxcitrinin
ChEBI ID CHEBI:200669
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H16O4
Net Charge 0
Average Mass 236.267
Monoisotopic Mass 236.10486
InChI InChI=1S/C13H16O4/c1-6(9(4)15)11-7(2)12(16)8(3)13(17)10(11)5-14/h5-6,16-17H,1-4H3/t6-/m1/s1
InChIKey CBUOBMSAFIYYEJ-ZCFIWIBFSA-N
SMILES O=C([C@H](C1=C(C(O)=C(C)C(=C1C)O)C=O)C)C
Metabolite of Species Details
Penicillium citrinum (NCBI:txid5077) See: PubMed
ChEBI Ontology
Outgoing Redoxcitrinin (CHEBI:200669) is a monoterpenoid (CHEBI:25409)
IUPAC Name
2,4-dihydroxy-3,5-dimethyl-6-[(2S)-3-oxobutan-2-yl]benzaldehyde
Manual Xref Database
27023177 ChemSpider
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