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CHEBI:229994 - Secoclausenamide

ChEBI IDCHEBI:229994
ChEBI NameSecoclausenamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H21NO3
Net Charge0
Average Mass299.370
Monoisotopic Mass299.15214
SMILESCN(CCc1ccccc1)C(=O)C(O)C(O)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-19(13-12-14-8-4-2-5-9-14)18(22)17(21)16(20)15-10-6-3-7-11-15/h2-11,16-17,20-21H,12-13H2,1H3
InChIKeyNCIQCBQQKSZYHT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
Secoclausenamide (CHEBI:229994) is a benzenes (CHEBI:22712)
IUPAC Name 
2,3-dihydroxy-N-methyl-3-phenyl-N-(2-phenylethyl)propanamide
Manual XrefsDatabases
8600260ChemSpider
HMDB0032962HMDB