CHEBI:212141 - Penicimarin G

ChEBI IDCHEBI:212141
ChEBI NamePenicimarin G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O5
Net Charge0
Average Mass280.320
Monoisotopic Mass280.13107
SMILESCOc1ccc(O)c2c1C(=O)O[C@H](CCC[C@@H](C)O)C2
InChIInChI=1S/C15H20O5/c1-9(16)4-3-5-10-8-11-12(17)6-7-13(19-2)14(11)15(18)20-10/h6-7,9-10,16-17H,3-5,8H2,1-2H3/t9-,10-/m1/s1
InChIKeyOLSLXAFCJSSETB-NXEZZACHSA-N
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - PubMed (27735855)
ChEBI Ontology
Outgoing Relation(s)
Penicimarin G (CHEBI:212141) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3R)-5-hydroxy-3-[(4R)-4-hydroxypentyl]-8-methoxy-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
58197352ChemSpider