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CHEBI:211256 - Penisochromane A

ChEBI IDCHEBI:211256
ChEBI NamePenisochromane A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12O5
Net Charge0
Average Mass224.212
Monoisotopic Mass224.06847
SMILESCOc1c(O)c(O)cc2c1CO[C@@H](C)C2=O
InChIInChI=1S/C11H12O5/c1-5-9(13)6-3-8(12)10(14)11(15-2)7(6)4-16-5/h3,5,12,14H,4H2,1-2H3/t5-/m0/s1
InChIKeyIMFAULVKFQEJPQ-YFKPBYRVSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (29726718)
ChEBI Ontology
Outgoing Relation(s)
Penisochromane A (CHEBI:211256) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
6,7-dihydroxy-8-methoxy-3-methyl-1H-isochromen-4-one
Manual XrefsDatabases
74122689ChemSpider