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CHEBI:17691 - N-feruloylglycine

Default Structure
ChEBI IDCHEBI:17691
ChEBI NameN-feruloylglycine
Stars
ASCII NameN-feruloylglycine
Secondary ChEBI IDsCHEBI:7271, CHEBI:12499, CHEBI:21700
Last Modified23 October 2015
DownloadsMolfile
FormulaC12H13NO5
Net Charge0
Average Mass251.238
Monoisotopic Mass251.07937
SMILESCOc1cc(/C=C/C(=O)NCC(=O)O)ccc1O
InChIInChI=1S/C12H13NO5/c1-18-10-6-8(2-4-9(10)14)3-5-11(15)13-7-12(16)17/h2-6,14H,7H2,1H3,(H,13,15)(H,16,17)/b5-3+
InChIKeyCLGNQAIRBLDHIN-HWKANZROSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N-feruloylglycine (CHEBI:17691) is a N-acylglycine (CHEBI:16180)
N-feruloylglycine (CHEBI:17691) is conjugate acid of N-feruloylglycinate (CHEBI:58236)
Incoming Relation(s)
N-feruloylglycinate (CHEBI:58236) is conjugate base of N-feruloylglycine (CHEBI:17691)
IUPAC Names 
{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}acetic acid
N-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]glycine
Synonym  Source
N-FeruloylglycineKEGG COMPOUND
Manual XrefsDatabases
C02564KEGG COMPOUND