UCSF

ZINC06661227

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2006 11 Yes

Popular Name: L-Histidine L-Histidine

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 1007-42-7 , 123333-71-1 , 15474-90-5 , 22835-06-9 , 351-50-8 , 4998-57-6 , 5934-29-2 , 6027-02-7 , 6459-59-2 , 7048-02-4 , 71-00-1 , 96185-91-0 , [4998-57-6] , [5934-29-2] , [645-35-2] , [6459-59-2] , [71-00-1]

Other Names:

"L-Histidine monohydrochloride monohydrate, 99%"

(2S)-2-amino-3-(1H-imidazol-4-yl)propanoate; L-histidinate(1-); L-histidine anion; L-histidine monoanion

(2S)-2-ammonio-3-(1H-imidazol-4-yl)propanoate; L-histidine

(L)-Histidine; (S)-2-Amino-3-(4-imidazolyl)propionsaeure; (S)-4-(2-Amino-2-carboxyethyl)imidazole; (S)-alpha-Amino-1H-imidazole-4-propanoic acid; (S)-alpha-Amino-1H-imidazole-4-propionic acid; 1H-Imidazole-4-alanine, (S)-; 1H-Imidazole-4-propanoic acid, a

(L)-Histidine; (S)-2-Amino-3-(4-imidazolyl)propionsaeure; (S)-4-(2-Amino-2-carboxyethyl)imidazole; (S)-alpha-Amino-1H-imidazole-4-propanoic acid; 1H-Imidazole-4-alanine, (S)-; 1H-Imidazole-4-propanoic acid, alpha-amino-, (S)-; 4-(2-Amino-2-carboxyethyl)im

(S)-1H-Imidazole-4-alanine; (S)-2-Amino-3-(4-imidazolyl)propionsaeure; (S)-4-(2-Amino-2-carboxyethyl)imidazole; (S)-a-Amino-1H-imidazole-4-propanoate; (S)-a-Amino-1H-imidazole-4-propanoic acid; (S)-alpha-Amino-1H-imidazole-4-propanoate; (S)-alpha-Amino-1H

(S)-1H-Imidazole-4-alanine; (S)-2-Amino-3-(4-imidazolyl)propionsaeure; (S)-4-(2-Amino-2-carboxyethyl)imidazole; (S)-Histidine; (S)-a-Amino-1H-imidazole-4-propanoate; (S)-a-Amino-1H-imidazole-4-propanoic acid; (S)-alpha-Amino-1H-imidazole-4-propanoate; (S)

(S)-1H-Imidazole-4-alanine;(S)-2-Amino-3-(4-imidazolyl)propionsaeure;(S)-4-(2-Amino-2-carboxyethyl)imidazole;(S)-a-Amino-1H-imidazole-4-propanoate;(S)-a-Amino-1H-imidazole-4-propanoic acid;(S)-alpha-Amino-1H-imidazole-4-propanoate;(S)-alpha-Amino-1H-imida

(S)-1H-Imidazole-4-alanine;(S)-2-Amino-3-(4-imidazolyl)propionsaeure;(S)-4-(2-Amino-2-carboxyethyl)imidazole;(S)-Histidine;(S)-a-Amino-1H-imidazole-4-propanoate;(S)-a-Amino-1H-imidazole-4-propanoic acid;(S)-alpha-Amino-1H-imidazole-4-propanoate;(S)-alpha-

(S)-2-Amino-3-(1H-imidazol-4-yl)propanoic acid dihydrochloride

(S)-2-Amino-3-(1H-imidazol-4-yl)propanoic acid hydrochloride hydrate

(S)-2-Amino-3-(4-imidazolyl)propionic acid

(S)-4-(2-Amino-2-carboxyethyl)imidazole

(S)-4-(2-Amino-2-carboxyethyl)imidazole; (S)-alpha-amino-1H-Imidazole-4-propanoic acid; H; HISTIDINE; His; L-(-)-histidine; L-Histidin

(S)-a-Amino-1H-imidazole-4-propanoic acid

(S)-alpha-amino-1H-imidazole-4-propanoic acid; 71-00-1; L-histidine; alpha-amino-4-imidazoleproprionic acid; glyoxaline-5-alanine; his; histidine

(S)-alpha-Amino-1H-imidazole-4-propionic acid

(S)-Histidine

tidine

2-Amino-3-(1H-imidazol-4-yl)-propionic acid

2-amino-3-(1H-imidazol-4-yl)propanoic acid

2-amino-3-(1H-imidazol-4-yl)propanoic acid dihydrochloride

2-Amino-3-(1H-imidazol-4-yl)propanoic acid hydrochloride

2-amino-3-(1H-imidazol-5-yl)propanoic acid

2-amino-3-(1H-imidazol-5-yl)propanoic acid hydrochloride

7048-02-4; D02072; L-Histidine monohydrochloride (JAN)

705

Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylicacid, 2-methyl ester, (1R,2S,3R,4S)-rel-

Bis(L-histidinato)cobalt; Bis(L-histidinato-N,N(sup 3),O)cobalt; Bis(L-histidine)cobalt; Cobalt, bis(L-histidinato)-; Cobalt, bis(L-histidinato-N,N(sup 3),O)-, (OC-6-3'3); Cobalt-histidine; Kobalt histidin [German]; LS-16626; alpha-Aminoimidazole-4-propio

Bis(L-histidinato)manganese tetrahydrate; LS-89201; Manganese, bis(L-histidinato)-, tetrahydrate; Manganese, bis(L-histidinato-N,O)-, tetrahydrate

C00768; DL-Histidine; Histidine; alpha-Amino-1H-imidazole-4-propionic acid

CHEBI:43239; CHEBI:43114; CHEBI:43190; CHEBI:43048; CHEBI:21324; CHEBI:13117; CHEBI:6240

D-Histidine

DL-Histidine

DL-Histidine free base

DL-Histidine hydrochloride, monohydrate, 98%

DL-Histidine hydrochloridemonohydrate

DL-Histidine monohydrochloride

DL-Histidine monohydrochloride monohydrate

DL-Histidine monohydrochloride monohydrate, 99%

Glyoxaline-5-alanine

H-DL-His-OH

H-DL-His-OH.HCl.H2O

H-His-OH

H-His-OH.HCl.H2O

Histidine

Histidine (INN

Histidine, monohydrochloride, monohydrate, L-; L-Histidine hydrochloride hydrate; LS-75854

L-(-)-Histidine

L-b-Alanine Histidine [305-84-0]; (H-b-Ala-His-OH)

L-b-ALANINE HISTIDINE; [305-84-0]

L-histidinate(1-)

L-Histidine HCl monohydrate

L-Histidine hydrochloride

L-Histidine hydrochloride monohydrate

L-Histidine hydrochloride monohydrate, 98%

L-Histidine monohydrochloride monohydrate

L-Histidine monohydrochloride monohydrate, 99%

L-histidine zwitterion

L-Histidine, 98%

L-Histidine, 98+%

L-histidine, monohydrochloride, monohydrate

L-histidine-2,5-3h

l-Histidine.HCl

LS-194218

MFCD00005208

MFCD00035203

MFCD00064315

MFCD00064555

MFCD00064556

MFCD00066569

MFCD00079365

MFCD00151027

MFCD00151028

MFCD05618262

NA

NF)

USAN

USP); Histidine Monohydrochloride (MI

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -3.00 1.48 -37.85 4 5 0 96 155.157 3 ↓
Lo Low (pH 4.5-6) -3.00 1.96 -79.54 5 5 1 98 156.165 3 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 0.601 Bitter DB
Mp [°C] 233 Acros Organics
MP 253 °C (dec.)(lit.) Indofine
MP 254 - 256 Enamine Building Blocks
MP 254...256 Enamine Building Blocks
Mp [°C] 282 Acros Organics
UniProt Database Links 4F2_MOUSE; A13CB_XENLA; A4_CAVPO; A4_HUMAN; A4_MACFA; A4_MOUSE; A4_PANTR; A4_PIG; A4_RAT; A4_SAISC; AACT_HUMAN; AADAT_HUMAN; AAH_ARATH; AAP1_ARATH; AAP2_ARATH; AAP5_ARATH; AARA_DICDI; AARA_PROST; AB23B_ARATH; AB24B_ARATH; ABCD3_DICDI; ABCGO_DICDI; ABDA_TR ChEBI
ALOGPS_SOLUBILITY 6.20e+01 g/l DrugBank-nutriceuticals
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Fluorochem
UniProt Database Links AFSQ2_STRCO; AHK1_ARATH; AHK2_ARATH; AHK3_ARATH; AHK4_ARATH; AHK5_ARATH; ARCB_ECO57; ARCB_ECOLI; ARCB_HAEIN; ARCB_SHIFL; CHEA_BACSU; CHEA_BORBU; CHEA_ECOLI; CHEA_ENTAK; CHEA_LISIN; CHEA_LISMO; CHEA_RHIME; CHEA_RHOSH; CHEA_SALTY; CHEA_THEMA; CHEA_TREPA; CH ChEBI
Melting_Point ca 240? dec. Alfa-Aesar
Melting_Point ca 240° dec. Alfa-Aesar
Melting_Point ca 250? dec. Alfa-Aesar
Melting_Point ca 250° dec. Alfa-Aesar
Melting_Point ca 281? dec. Alfa-Aesar
Melting_Point ca 281° dec. Alfa-Aesar
Patent Database Links EP1182261; EP1364957; EP1364958; EP1400529; EP1566180; EP1577317; EP1600162; EP1609462; EP1616963; EP1627884; EP1632233; EP1652534; EP1695983; EP1724284; EP1762232; EP1774858; EP1803445; EP1849466; EP1869977; EP1938798; EP1972349; EP1975176; EP1983044; US ChEBI
Reactome Database Links REACT_111140; REACT_111222; REACT_115661; REACT_1225; REACT_13482; REACT_13564; REACT_13642; REACT_13659; REACT_14802; REACT_15315; REACT_15376; REACT_19313; REACT_19377; REACT_75867; REACT_75920 ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Notes USP, Pyrogen free Apollo Scientific Bioactives

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Amino acid transport across the plasma membrane
Antigen Presentation: Folding, assembly and peptide loading of class I MHC
Antigen processing: Ubiquitination & Proteasome degradation
Cross-presentation of soluble exogenous antigens (endosomes)
Cytosolic tRNA aminoacylation
Endosomal/Vacuolar pathway
ER-Phagosome pathway
Glutathione synthesis and recycling
Histidine catabolism
Mitochondrial tRNA aminoacylation
Na+/Cl- dependent neurotransmitter transporters
Proton/oligonucleotide cotransporters

Analogs ( Draw Identity 99% 90% 80% 70% )