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CHEBI:223678 - Peniciisocoumarin H

ChEBI IDCHEBI:223678
ChEBI NamePeniciisocoumarin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O5
Net Charge0
Average Mass266.293
Monoisotopic Mass266.11542
SMILESC[C@@H](O)CCC[C@H]1OC(=O)c2c(O)cccc2[C@@H]1O
InChIInChI=1S/C14H18O5/c1-8(15)4-2-7-11-13(17)9-5-3-6-10(16)12(9)14(18)19-11/h3,5-6,8,11,13,15-17H,2,4,7H2,1H3/t8-,11-,13+/m1/s1
InChIKeyMKGJZZJGIQIYRM-DYLAAIIWSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (30990038)
ChEBI Ontology
Outgoing Relation(s)
Peniciisocoumarin H (CHEBI:223678) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3R,4S)-4,8-dihydroxy-3-[(4R)-4-hydroxypentyl]-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
74832022ChemSpider