CHEBI:198186 - Violaceoid E

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 Violaceoid E
ChEBI ID CHEBI:198186
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H22O4
Net Charge 0
Average Mass 254.326
Monoisotopic Mass 254.15181
InChI InChI=1S/C14H22O4/c1-2-3-4-5-6-7-10-11(9-15)12(16)8-13(17)14(10)18/h6-7,13-15,17-18H,2-5,8-9H2,1H3/t13-,14+/m0/s1
InChIKey STNLGQLIXQWBJR-UONOGXRCSA-N
SMILES O=C1C(=C(C=CCCCCC)[C@@H](O)[C@H](C1)O)CO
Metabolite of Species Details
Aspergillus violaceofuscus (NCBI:txid657443) See: PubMed
ChEBI Ontology
Outgoing Violaceoid E (CHEBI:198186) is a cyclohexenones (CHEBI:48953)
IUPAC Name
(4R,5S)-3-hept-1-enyl-4,5-dihydroxy-2-(hydroxymethyl)cyclohex-2-en-1-one