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CHEBI:212516 - Deoxyenhygrolide A

ChEBI IDCHEBI:212516
ChEBI NameDeoxyenhygrolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H22O2
Net Charge0
Average Mass318.416
Monoisotopic Mass318.16198
SMILESCC(C)CC1=C(Cc2ccccc2)C(=O)O/C1=C\c1ccccc1
InChIInChI=1S/C22H22O2/c1-16(2)13-19-20(14-17-9-5-3-6-10-17)22(23)24-21(19)15-18-11-7-4-8-12-18/h3-12,15-16H,13-14H2,1-2H3/b21-15-
InChIKeyRCKKKANUKRWEDP-QNGOZBTKSA-N
Species of MetaboliteComponentSourceComments
Enhygromyxaspecies (ncbitaxon:2666105) - PubMed (28383484)
ChEBI Ontology
Outgoing Relation(s)
Deoxyenhygrolide A (CHEBI:212516) is a butenolide (CHEBI:50523)
IUPAC Name 
(5Z)-3-benzyl-5-benzylidene-4-(2-methylpropyl)uran-2-one
Manual XrefsDatabases
61708483ChemSpider