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CHEBI:214114 - Nigerrimin A

ChEBI IDCHEBI:214114
ChEBI NameNigerrimin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H17NO4
Net Charge0
Average Mass287.315
Monoisotopic Mass287.11576
SMILESO=C(N[C@H](CO)Cc1ccccc1)c1ccc(O)c(O)c1
InChIInChI=1S/C16H17NO4/c18-10-13(8-11-4-2-1-3-5-11)17-16(21)12-6-7-14(19)15(20)9-12/h1-7,9,13,18-20H,8,10H2,(H,17,21)/t13-/m0/s1
InChIKeyPJPGHPWWCHJZNR-ZDUSSCGKSA-N
Species of MetaboliteComponentSourceComments
Retiboletus nigerrimus (ncbitaxon:889443) - DOI (10.5560/znb.2013-3050)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Application:
central nervous system stimulant  Any drug that enhances the activity of the central nervous system.
ChEBI Ontology
Outgoing Relation(s)
Nigerrimin A (CHEBI:214114) is a amphetamines (CHEBI:35338)
IUPAC Name 
3,4-dihydroxy-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
Manual XrefsDatabases
51509188ChemSpider