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CHEBI:200431 - Gombapyrone B

ChEBI IDCHEBI:200431
ChEBI NameGombapyrone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O3
Net Charge0
Average Mass376.496
Monoisotopic Mass376.20384
SMILESC=CCc1cc(C)ccc1/C=C\C=C/C(C)=C/Cc1oc(=O)c(C)c(O)c1C
InChIInChI=1S/C25H28O3/c1-6-9-22-16-18(3)12-14-21(22)11-8-7-10-17(2)13-15-23-19(4)24(26)20(5)25(27)28-23/h6-8,10-14,16,26H,1,9,15H2,2-5H3/b10-7-,11-8-,17-13+
InChIKeyAJMZNTNWNUXQMW-FIAMRCMKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (19644516)
ChEBI Ontology
Outgoing Relation(s)
Gombapyrone B (CHEBI:200431) is a styrenes (CHEBI:26799)
IUPAC Name 
4-hydroxy-3,5-dimethyl-6-[(2E,4Z,6Z)-3-methyl-7-(4-methyl-2-prop-2-enylphenyl)hepta-2,4,6-trienyl]pyran-2-one
Manual XrefsDatabases
78435588ChemSpider