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CHEBI:221854 - Penicitrinol I

ChEBI IDCHEBI:221854
ChEBI NamePenicitrinol I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESCc1c(O)cc2c3c1[C@H](C)[C@@H](C)O[C@H]3C[C@@](C)(O)O2
InChIInChI=1S/C15H20O4/c1-7-9(3)18-12-6-15(4,17)19-11-5-10(16)8(2)13(7)14(11)12/h5,7,9,12,16-17H,6H2,1-4H3/t7-,9-,12+,15+/m1/s1
InChIKeyLIDCFZYKZYLCJT-ARYGOODISA-N
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - DOI (10.3987/COM-11-12234)
ChEBI Ontology
Outgoing Relation(s)
Penicitrinol I (CHEBI:221854) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3S,5S,7R,8S)-3,7,8,10-tetramethyl-2,6-dioxatricyclo[7.3.1.05,13]trideca-1(13),9,11-triene-3,11-diol
Manual XrefsDatabases
28185095ChemSpider