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CHEBI:186350 - Elephantorrhizol

ChEBI IDCHEBI:186350
ChEBI NameElephantorrhizol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O8
Net Charge0
Average Mass322.269
Monoisotopic Mass322.06887
SMILESOc1ccc([C@H]2Oc3c(O)c(O)c(O)c(O)c3C[C@@H]2O)cc1O
InChIInChI=1S/C15H14O8/c16-7-2-1-5(3-8(7)17)14-9(18)4-6-10(19)11(20)12(21)13(22)15(6)23-14/h1-3,9,14,16-22H,4H2/t9-,14+/m0/s1
InChIKeyPONGJRZSHJPTOF-LKFCYVNXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Elephantorrhizol (CHEBI:186350) is a catechin (CHEBI:23053)
IUPAC Name 
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,6,7,8-pentol
Manual XrefsDatabases
LMPK12020151LIPID MAPS
10161183ChemSpider