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ChEBI
> Main
CHEBI:73018 - tiglylglycine
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ChEBI Ontology
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ChEBI Name
tiglylglycine
ChEBI ID
CHEBI:73018
Definition
An
N
-acylglycine that is glycine with an amine hydrogen substituted by a 2-methylbut-2-enoyl (tiglyl) group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
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Molfile
Formula
C7H11NO3
Net Charge
0
Average Mass
157.16710
Monoisotopic Mass
157.07389
InChI
InChI=1S/C7H11NO3/c1-3-5(2)7(11)8-4-6(9)10/h3H,4H2,1-2H3,(H,8,11)(H,9,10)/b5-3+
InChIKey
WRUSVQOKJIDBLP-HWKANZROSA-N
SMILES
C\C=C(/C)C(=O)NCC(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
tiglylglycine (
CHEBI:73018
)
has functional parent
glycine (
CHEBI:15428
)
tiglylglycine (
CHEBI:73018
)
has role
metabolite (
CHEBI:25212
)
tiglylglycine (
CHEBI:73018
)
is a
N
-acylglycine (
CHEBI:16180
)
IUPAC Name
N
-[(2
E
)-2-methylbut-2-enoyl]glycine
Synonym
Source
N-Tiglylglycine
HMDB
Manual Xref
Database
HMDB0000959
HMDB
View more database links
Registry Numbers
Types
Sources
2206218
Reaxys Registry Number
Reaxys
35842-45-6
CAS Registry Number
ChemIDplus
Last Modified
23 October 2015