EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:204893 - Petchiate B

ChEBI IDCHEBI:204893
ChEBI NamePetchiate B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O5
Net Charge0
Average Mass238.239
Monoisotopic Mass238.08412
SMILESCCOC(=O)/C=C(\C(C)=O)c1ccc(CO)o1
InChIInChI=1S/C12H14O5/c1-3-16-12(15)6-10(8(2)14)11-5-4-9(7-13)17-11/h4-6,13H,3,7H2,1-2H3/b10-6+
InChIKeyRNXUXOBDUSSLDU-UXBLZVDNSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (26277755)
ChEBI Ontology
Outgoing Relation(s)
Petchiate B (CHEBI:204893) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
ethyl (Z)-3-[5-(hydroxymethyl)uran-2-yl]-4-oxopent-2-enoate
Manual XrefsDatabases
78435901ChemSpider