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ChEBI
> Main
CHEBI:189415 - α-methyl-
L
-histidine
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ChEBI Ontology
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ChEBI Name
α-methyl-
L
-histidine
ChEBI ID
CHEBI:189415
ChEBI ASCII Name
alpha-methyl-L-histidine
Definition
An α-methylhistidine that has
L
-configuration.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C7H11N3O2
Net Charge
0
Average Mass
169.184
Monoisotopic Mass
169.08513
InChI
InChI=1S/C7H11N3O2/c1-7(8,6(11)12)2-5-3-9-4-10-5/h3-4H,2,8H2,1H3,(H,9,10)(H,11,12)/t7-/m0/s1
InChIKey
HRRYYCWYCMJNGA-ZETCQYMHSA-N
SMILES
C[C@](N)(CC1=CN=CN1)C(O)=O
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):
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
(via
alpha-methylhistidine
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
α-methyl-
L
-histidine (
CHEBI:189415
)
has functional parent
L
-histidine (
CHEBI:15971
)
α-methyl-
L
-histidine (
CHEBI:189415
)
is a
α-methylhistidine (
CHEBI:70960
)
IUPAC Name
α-methyl-
L
-histidine
Synonyms
Sources
(2
S
)-2-amino-3-(1
H
-imidazol-5-yl)-2-methylpropanoic acid
IUPAC
α-methylhistidine
ChemIDplus
Manual Xrefs
Databases
132894
ChemSpider
CPD-10906
MetaCyc
View more database links
Registry Number
Type
Source
587-20-2
CAS Registry Number
ChemIDplus
Citation
Type
Source
3518722
PubMed citation
Europe PMC
Last Modified
20 January 2022