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CHEBI:208907 - Penicitrinol N

ChEBI IDCHEBI:208907
ChEBI NamePenicitrinol N
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O6
Net Charge0
Average Mass362.422
Monoisotopic Mass362.17294
SMILESCO[C@]12CCCC[C@H]1[C@H]1O[C@H](C)[C@@H](C)c3c(C)c(O)c(C(=O)O)c(c31)O2
InChIInChI=1S/C20H26O6/c1-9-11(3)25-17-12-7-5-6-8-20(12,24-4)26-18-14(17)13(9)10(2)16(21)15(18)19(22)23/h9,11-12,17,21H,5-8H2,1-4H3,(H,22,23)/t9-,11-,12+,17-,20+/m1/s1
InChIKeyCTZMTGUUUISDOM-RROSDGJCSA-N
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - DOI (10.3987/com-15-13178)
ChEBI Ontology
Outgoing Relation(s)
Penicitrinol N (CHEBI:208907) is a xanthenes (CHEBI:38835)
IUPAC Name 
(1R,2S,7S,14S,15R)-11-hydroxy-7-methoxy-12,14,15-trimethyl-8,16-dioxatetracyclo[7.7.1.02,7.013,17]heptadeca-9(17),10,12-triene-10-carboxylic acid
Manual XrefsDatabases
35516657ChemSpider