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CHEBI:200869 - Trichodermaketone D

ChEBI IDCHEBI:200869
ChEBI NameTrichodermaketone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O3
Net Charge0
Average Mass264.365
Monoisotopic Mass264.17254
SMILESCCCCCC/C=C/[C@H]1CC2=C(O1)[C@H](O)CCC2=O
InChIInChI=1S/C16H24O3/c1-2-3-4-5-6-7-8-12-11-13-14(17)9-10-15(18)16(13)19-12/h7-8,12,15,18H,2-6,9-11H2,1H3/b8-7+/t12-,15+/m0/s1
InChIKeyCPAQHEJNJNOQTQ-RMRLKUHTSA-N
Species of MetaboliteComponentSourceComments
Trichoderma koningii (ncbitaxon:97093) - PubMed (20384316)
ChEBI Ontology
Outgoing Relation(s)
Trichodermaketone D (CHEBI:200869) is a benzofurans (CHEBI:35259)
IUPAC Name 
(2R,7R)-7-hydroxy-2-[(E)-oct-1-enyl]-3,5,6,7-tetrahydro-2H-1-benzouran-4-one
Manual XrefsDatabases
24671800ChemSpider