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CHEBI:214967 - Speciosin W

ChEBI IDCHEBI:214967
ChEBI NameSpeciosin W
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O4
Net Charge0
Average Mass278.348
Monoisotopic Mass278.15181
SMILESCC(C)=CCC1(O)CC(=O)C=C(C#CC(C)CO)C1O
InChIInChI=1S/C16H22O4/c1-11(2)6-7-16(20)9-14(18)8-13(15(16)19)5-4-12(3)10-17/h6,8,12,15,17,19-20H,7,9-10H2,1-3H3
InChIKeyMSGWRMXTWQZSBJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Stagonosporaspecies (ncbitaxon:1904476) - DOI (10.1016/j.phytol.2020.07.016)
ChEBI Ontology
Outgoing Relation(s)
Speciosin W (CHEBI:214967) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
4,5-dihydroxy-3-(4-hydroxy-3-methylbut-1-ynyl)-5-(3-methylbut-2-enyl)cyclohex-2-en-1-one