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CHEBI:186025 - Cyrtopterin

ChEBI IDCHEBI:186025
ChEBI NameCyrtopterin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O10
Net Charge0
Average Mass462.451
Monoisotopic Mass462.15260
SMILESCc1c(O)c2c(c(C)c1OC1OC(CO)C(O)C(O)C1O)OC(c1ccc(O)cc1)CC2=O
InChIInChI=1S/C23H26O10/c1-9-17(27)16-13(26)7-14(11-3-5-12(25)6-4-11)31-22(16)10(2)21(9)33-23-20(30)19(29)18(28)15(8-24)32-23/h3-6,14-15,18-20,23-25,27-30H,7-8H2,1-2H3
InChIKeyWBNRHHBGMFXQKL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Cyrtopterin (CHEBI:186025) is a flavonoids (CHEBI:72544)
Cyrtopterin (CHEBI:186025) is a glycoside (CHEBI:24400)
IUPAC Name 
5-hydroxy-2-(4-hydroxyphenyl)-6,8-dimethyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846351ChemSpider
LMPK12140232LIPID MAPS