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(Q106345600)
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English
N(alpha),N(alpha)-dimethyl-L-histidine zwitterion
chemical compound
(2S)-2-(dimethylazaniumyl)-3-(1H-imidazol-4-yl)propanoate
In more languages
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
part of
dimethylhistidine N-methyltransferase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
183.100776656
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
N,N-dimethyl-L-histidine
1 reference
based on heuristic
inferred from InChI
tautomer of
N,N-dimethyl-L-histidine
1 reference
stated in
ChEBI release 2021-03-01
chemical formula
C₈H₁₃N₃O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CN(C)C(Cc1cnc[nH]1)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CN(C)[C@@H](Cc1cnc[nH]1)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C8H13N3O2/c1-11(2)7(8(12)13)3-6-4-9-5-10-6/h4-5,7H,3H2,1-2H3,(H,9,10)(H,12,13)/t7-/m0/s1
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
1 reference
stated in
ChEBI release 2021-03-01
CAS Registry Number
24940-57-6
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
ChEBI ID
57610
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
SureChEMBL ID
SCHEMBL198656
1 reference
based on heuristic
inferred from InChIKey
SCHEMBL198655
1 reference
based on heuristic
inferred from InChIKey
MassBank accession ID
MSBNK-Keio_Univ-KO000669
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO000673
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO002786
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO002787
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO002788
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO002789
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO000670
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO000672
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO000671
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO002790
1 reference
InChIKey
IMOBSLOLPCWZKQ-ZETCQYMHSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
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