L-Histidine

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Systematic / IUPAC Name: Histidine

ID: Reference473

Other Names: (S)-4-(2-Amino-2-carboxyethyl)imidazole;
(S)-α-Amino-1H-imidazole-4-propanoic acid;
1H-Imidazole-4-alanine, (S)-;
4-(2-Amino-2-carboxyethyl)imidazole;
α-Amino-4(or 5)-imidazolepropionic acid ; more

Formula: C6H9N3O2

Class: Endogenous Metabolites

Spectral Data

L-Histidine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 6
No. of Spectra 846
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI; APCI; NSI
Analyzers IT; FT
Last Modification 2/10/2015 1:32:35 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
InChI Key HNDVDQJCIGZPNO-YFKPBYRVSA-N
Canonical SMILES C1=C(N=CN1)CC(C(=O)O)N
CAS 150356
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Other Names (S)-4-(2-Amino-2-carboxyethyl)imidazole;
(S)-α-Amino-1H-imidazole-4-propanoic acid;
1H-Imidazole-4-alanine, (S)-;
4-(2-Amino-2-carboxyethyl)imidazole;
α-Amino-4(or 5)-imidazolepropionic acid;
α-Amino-1H-imidazole-4-propionic acid, (S)-;
1H-Imidazole-4-propanoic acid, α-amino-, (S)-;
(S)-2-Amino-3-(4-imidazolyl)propionic acid;
(2S)-2-Amino-3-(1H-imidazol-4-yl)propanoic acid;
(2S)-2-Amino-3-(1H-imidazol-5-yl)propanoic acid;
Amino-1H-imidazole-4-propanoic acid;
L-Histidine;
L-(-)-Histidine;
Histidine, L-;
L-His

In Other Databases

ChEBI CHEBI:15971; CHEBI:57595
Wikipedia Histidine
KEGG C00135; D00032
HMDb HMDB00177
PubChem 6274
ChEMBL CHEMBL17962
ChemSpider 6038
ChemIDPlus 000071001; 026062486; 012561670; 023661485