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ChEBI
> Main
CHEBI:133746 -
N
-acetyltryptophanate
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ChEBI Name
N
-acetyltryptophanate
ChEBI ID
CHEBI:133746
ChEBI ASCII Name
N-acetyltryptophanate
Definition
A monocarboxylic acid anion which is obtained by deprotonation of the carboxy group of
N
-acetyltryptophan.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H13N2O3
Net Charge
-1
Average Mass
245.254
Monoisotopic Mass
245.09317
InChI
InChI=1S/C13H14N2O3/c1-
8(16)
15-
12(13(17)
18)
6-
9-
7-
14-
11-
5-
3-
2-
4-
10(9)
11/h2-
5,7,12,14H,6H2,1H3,(H,15,16)
(H,17,18)
/p-
1
InChIKey
DZTHIGRZJZPRDV-UHFFFAOYSA-M
SMILES
C(C([O-])=O)(NC(C)=O)CC=1C2=CC=CC=C2NC1
Roles Classification
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
N
-acetyltryptophanate (
CHEBI:133746
)
has role
metabolite (
CHEBI:25212
)
N
-acetyltryptophanate (
CHEBI:133746
)
is a
monocarboxylic acid anion (
CHEBI:35757
)
N
-acetyltryptophanate (
CHEBI:133746
)
is conjugate base of
N
-acetyltryptophan (
CHEBI:70976
)
Incoming
N
-acetyltryptophan (
CHEBI:70976
)
is conjugate acid of
N
-acetyltryptophanate (
CHEBI:133746
)
IUPAC Name
2-acetamido-3-(1
H
-indol-3-yl)propanoate
Synonyms
Sources
acetyltryptophan(1−)
ChEBI
acetyltryptophanate
ChEBI
N
-acetyltryptophan(1−)
ChEBI
Registry Number
Type
Source
5294451
Reaxys Registry Number
Reaxys
Last Modified
17 October 2016