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ChEBI
> Main
CHEBI:70976 -
N
-acetyltryptophan
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ChEBI Name
N
-acetyltryptophan
ChEBI ID
CHEBI:70976
ChEBI ASCII Name
N-acetyltryptophan
Definition
An
N
-acetylamino acid that is the
N
-acetyl derivative of tryptophan.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H14N2O3
Net Charge
0
Average Mass
246.26190
Monoisotopic Mass
246.10044
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)
InChIKey
DZTHIGRZJZPRDV-UHFFFAOYSA-N
SMILES
CC(=O)NC(Cc1c[nH]c2ccccc12)C(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
N
-acetyltryptophan (
CHEBI:70976
)
has role
metabolite (
CHEBI:25212
)
N
-acetyltryptophan (
CHEBI:70976
)
is a
N
-acetyl-amino acid (
CHEBI:21575
)
N
-acetyltryptophan (
CHEBI:70976
)
is a
tryptophan derivative (
CHEBI:27164
)
N
-acetyltryptophan (
CHEBI:70976
)
is conjugate acid of
N
-acetyltryptophanate (
CHEBI:133746
)
Incoming
N
-acetyltryptophanate (
CHEBI:133746
)
is conjugate base of
N
-acetyltryptophan (
CHEBI:70976
)
IUPAC Names
2-(acetylamino)-3-(1
H
-indol-3-yl)propanoic acid
N
-acetyltryptophan
Synonyms
Sources
Acetyltryptophan
ChemIDplus
N
-acetyl-
D
L
-tryptophan
ChEBI
N
-acetyltryptophane
ChEBI
Registry Numbers
Types
Sources
487262
Reaxys Registry Number
Reaxys
87-32-1
CAS Registry Number
ChemIDplus
Citation
Type
Source
22770225
PubMed citation
Europe PMC
Last Modified
17 July 2018