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CHEBI:217757 - 2-O-methylbutyrolactone II

ChEBI IDCHEBI:217757
ChEBI Name2-O-methylbutyrolactone II
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O7
Net Charge0
Average Mass370.357
Monoisotopic Mass370.10525
SMILESCOC(=O)[C@]1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
InChIInChI=1S/C20H18O7/c1-25-17-16(13-5-9-15(22)10-6-13)20(19(24)26-2,27-18(17)23)11-12-3-7-14(21)8-4-12/h3-10,21-22H,11H2,1-2H3/t20-/m1/s1
InChIKeyDYMYDSWEIIXYNX-HXUWFJFHSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (26363883)
ChEBI Ontology
Outgoing Relation(s)
2-O-methylbutyrolactone II (CHEBI:217757) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
methyl (2R)-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-4-methoxy-5-oxouran-2-carboxylate
Manual XrefsDatabases
40256558ChemSpider