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CHEBI:172106 - Porson

ChEBI IDCHEBI:172106
ChEBI NamePorson
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H26O6
Net Charge0
Average Mass386.444
Monoisotopic Mass386.17294
SMILESCOc1c2cc(c(OC)c1OC)-c1cc(ccc1O)CC(O)C(=O)CCCC2
InChIInChI=1S/C22H26O6/c1-26-20-14-6-4-5-7-18(24)19(25)11-13-8-9-17(23)15(10-13)16(12-14)21(27-2)22(20)28-3/h8-10,12,19,23,25H,4-7,11H2,1-3H3
InChIKeyIFQDEGDKLBEYHN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Porson (CHEBI:172106) is a biphenyls (CHEBI:22888)
IUPAC Name 
3,8-dihydroxy-15,16,17-trimethoxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one
Manual XrefsDatabases
28425541ChemSpider