CHEBI:17691 - N-feruloylglycine

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ChEBI Name N-feruloylglycine
ChEBI ID CHEBI:17691
ChEBI ASCII Name N-feruloylglycine
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12499, CHEBI:21700, CHEBI:7271
Supplier Information
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Formulae C12H13NO5
C12H13NO5
Net Charge 0
Average Mass 251.23530
Monoisotopic Mass 251.07937
InChI InChI=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+
InChIKey CLGNQAIRBLDHIN-HWKANZROSA-N
SMILES COc1cc(\C=C\C(=O)NCC(O)=O)ccc1O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-feruloylglycine (CHEBI:17691) is a N-acylglycine (CHEBI:16180)
N-feruloylglycine (CHEBI:17691) is conjugate acid of N-feruloylglycinate (CHEBI:58236)
Incoming N-feruloylglycinate (CHEBI:58236) is conjugate base of N-feruloylglycine (CHEBI:17691)
IUPAC Names
N-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]glycine
{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}acetic acid
Synonym Source
N-Feruloylglycine KEGG COMPOUND
Manual Xref Database
C02564 KEGG COMPOUND
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Last Modified
23 October 2015