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CHEBI:215862 - Penicisochroman H

ChEBI IDCHEBI:215862
ChEBI NamePenicisochroman H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O4
Net Charge0
Average Mass260.289
Monoisotopic Mass260.10486
SMILESCC1=Cc2ccc3c(c2CO1)O[C@@](O)(C(C)C)C3=O
InChIInChI=1S/C15H16O4/c1-8(2)15(17)14(16)11-5-4-10-6-9(3)18-7-12(10)13(11)19-15/h4-6,8,17H,7H2,1-3H3/t15-/m0/s1
InChIKeyAGQPNYJENDWLLV-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1016/j.phytol.2014.06.018)
ChEBI Ontology
Outgoing Relation(s)
Penicisochroman H (CHEBI:215862) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(2S)-2-hydroxy-7-methyl-2-propan-2-yl-9H-uro[3,2-h]isochromen-3-one
Manual XrefsDatabases
78438625ChemSpider