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CHEBI:193457 - 2,5-dihydroxy-4-(2-hydroxyphenyl)-5-(methylamino)-3-phenylpentanoic acid

ChEBI IDCHEBI:193457
ChEBI Name2,5-dihydroxy-4-(2-hydroxyphenyl)-5-(methylamino)-3-phenylpentanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H21NO5
Net Charge0
Average Mass331.368
Monoisotopic Mass331.14197
SMILESCNC(O)C(c1ccccc1O)C(c1ccccc1)C(O)C(=O)O
InChIInChI=1S/C18H21NO5/c1-19-17(22)15(12-9-5-6-10-13(12)20)14(16(21)18(23)24)11-7-3-2-4-8-11/h2-10,14-17,19-22H,1H3,(H,23,24)
InChIKeyKFMXDICDNMVTJN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
2,5-dihydroxy-4-(2-hydroxyphenyl)-5-(methylamino)-3-phenylpentanoic acid (CHEBI:193457) is a stilbenoid (CHEBI:26776)
IUPAC Name 
2,5-dihydroxy-4-(2-hydroxyphenyl)-5-(methylamino)-3-phenylpentanoic acid