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CHEBI:206476 - Penicitor A

ChEBI IDCHEBI:206476
ChEBI NamePenicitor A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O5
Net Charge0
Average Mass302.326
Monoisotopic Mass302.11542
SMILESCCC[C@H]1Cc2cc3cc(O)cc(OC)c3c(O)c2C(=O)O1
InChIInChI=1S/C17H18O5/c1-3-4-12-7-10-5-9-6-11(18)8-13(21-2)14(9)16(19)15(10)17(20)22-12/h5-6,8,12,18-19H,3-4,7H2,1-2H3/t12-/m0/s1
InChIKeyLQXFOORJOXBOQS-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies SCS-KFD08 (ncbitaxon:1808020) - PubMed (27709333)
ChEBI Ontology
Outgoing Relation(s)
Penicitor A (CHEBI:206476) is a organic heterotricyclic compound (CHEBI:26979)
Penicitor A (CHEBI:206476) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S)-7,10-dihydroxy-9-methoxy-3-propyl-3,4-dihydrobenzo[g]isochromen-1-one
Manual XrefsDatabases
62816748ChemSpider