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> Main
CHEBI:72821 - 1-methyltryptophan
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ChEBI Ontology
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ChEBI Name
1-methyltryptophan
ChEBI ID
CHEBI:72821
Definition
A tryptophan derivative that is tryptophan carrying a single methyl substituent at position 1 on the indole.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
SBeisken
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Read full article at Wikipedia
Formula
C12H14N2O2
Net Charge
0
Average Mass
218.25180
Monoisotopic Mass
218.10553
InChI
InChI=1S/C12H14N2O2/c1-14-7-8(6-10(13)12(15)16)9-4-2-3-5-11(9)14/h2-5,7,10H,6,13H2,1H3,(H,15,16)
InChIKey
ZADWXFSZEAPBJS-UHFFFAOYSA-N
SMILES
Cn1cc(CC(N)C(O)=O)c2ccccc12
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
EC 1.13.11.52 (indoleamine 2,3-dioxygenase) inhibitor
An EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 atoms of oxygen) inhibitor that interferes with the action of indoleamine 2,3-dioxygenase (EC 1.13.11.52).
Application
(s):
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1-methyltryptophan (
CHEBI:72821
)
has role
antineoplastic agent (
CHEBI:35610
)
1-methyltryptophan (
CHEBI:72821
)
has role
EC 1.13.11.52 (indoleamine 2,3-dioxygenase) inhibitor (
CHEBI:72854
)
1-methyltryptophan (
CHEBI:72821
)
is a
non-proteinogenic α-amino acid (
CHEBI:83925
)
1-methyltryptophan (
CHEBI:72821
)
is a
tryptophan derivative (
CHEBI:27164
)
IUPAC Name
1-methyltryptophan
Synonyms
Sources
1-methyl-
D
L
-tryptophan
ChemIDplus
N
-methyl-
D
L
-tryptophan
ChEBI
N
-methyltryptophan
ChEBI
Manual Xref
Database
1-Methyltryptophan
Wikipedia
View more database links
Registry Numbers
Types
Sources
20071
Reaxys Registry Number
Reaxys
26988-72-7
CAS Registry Number
ChemIDplus
Citations
Types
Sources
18195714
PubMed citation
Europe PMC
19307751
PubMed citation
Europe PMC
19461669
PubMed citation
Europe PMC
20424892
PubMed citation
Europe PMC
20435158
PubMed citation
Europe PMC
21526853
PubMed citation
Europe PMC
22068654
PubMed citation
Europe PMC
22131334
PubMed citation
Europe PMC
22184722
PubMed citation
Europe PMC
22294267
PubMed citation
Europe PMC
22320717
PubMed citation
Europe PMC
22504306
PubMed citation
Europe PMC
22527253
PubMed citation
Europe PMC
22594922
PubMed citation
Europe PMC
22615663
PubMed citation
Europe PMC
Last Modified
08 January 2015