CHEBI:212516 - Deoxyenhygrolide A

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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 Deoxyenhygrolide A
ChEBI ID CHEBI:212516
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H22O2
Net Charge 0
Average Mass 318.416
Monoisotopic Mass 318.16198
InChI InChI=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-
InChIKey RCKKKANUKRWEDP-QNGOZBTKSA-N
SMILES O=C1O/C(=C\C2=CC=CC=C2)/C(=C1CC3=CC=CC=C3)CC(C)C
Metabolite of Species Details
Enhygromyxaspecies (NCBI:txid2666105) See: PubMed
ChEBI Ontology
Outgoing Deoxyenhygrolide A (CHEBI:212516) is a butenolide (CHEBI:50523)
IUPAC Name
(5Z)-3-benzyl-5-benzylidene-4-(2-methylpropyl)uran-2-one
Manual Xref Database
61708483 ChemSpider
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