UCSF

ZINC13282319

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 16 Yes

Popular Name: L-Carnosine L-Carnosine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 107667-60-7 , 305-84-0 , [305-84-0]

Other Names:

(2S)-2-(3-aminopropanamido)-3-(3H-imidazol-4-yl)propanoic acid

(2S)-2-[(3-azaniumylpropanoyl)amino]-3-(1H-imidazol-4-yl)propanoate; carnosine

305-84-0; C00386; Carnosine; Nalpha-(beta-alanyl)-L-histidine

b-Alanyl-L-histidine; b-Alanylhistidine; Beta-Alanyl-L-histidine; beta-Alanylhistidine; Carnosine; Ignotine; Karnozin; Karnozzn; L-Carnosine; N-(3-Aminopropanoyl)histidine; N-(b-Alanyl)-L-histidine; N-b-alanyl-L-Histidine; N-beta-alanyl-L-Histidine; Sevit

b-Alanyl-L-histidine;b-Alanylhistidine;beta-Alanyl-L-histidine;beta-Alanylhistidine;Carnosine;Ignotine;Karnozin;Karnozzn;L-Carnosine;N-(3-Aminopropanoyl)histidine;N-(b-Alanyl)-L-histidine;N-b-Alanyl-L-Histidine;N-beta-Alanyl-L-Histidine;Sevitin

beta-Alanyl-L-histidine

BRN 0087671; Carnosine; EINECS 206-169-9; Ignotine; Karnozin; Karnozzn; L-Carnosine; L-Histidine, N-beta-alanyl-; L-Histidine, beta-alanyl-; LS-75839; N-2-M; NSC 524045; beta-Alanyl-L-histidine

carnosinate

carnosine

Carnosine zinc complex

carnosine zwitterion

Carnosine; Ignotine; Karnozin; Karnozzn; L-Carnosine; L-HISTIDINE, N-beta-ALANYL-; L-Histidine, beta-alanyl-; N-2-M; Nalpha-(beta-alanyl)-L-histidine; beta-Alanyl-L-histidine; bmse001002

Carnosine; Ignotine; Karnozin; Karnozzn; L-Carnosine; N-(3-Aminopropanoyl)histidine; N-(b-Alanyl)-L-histidine; N-b-Alanyl-L-Histidine; N-beta-Alanyl-L-Histidine; Sevitin; b-Alanyl-L-histidine; b-Alanylhistidine; beta-Alanyl-L-histidine; beta-Alanylhistidi

Carnosine;Ignotine;Karnozin;Karnozzn;L-Carnosine;N-(3-Aminopropanoyl)histidine;N-(b-Alanyl)-L-histidine;N-b-Alanyl-L-Histidine;N-beta-Alanyl-L-Histidine;Sevitin;b-Alanyl-L-histidine;b-Alanylhistidine;beta-Alanyl-L-histidine;beta-Alanylhistidine

CAZ

CHEBI:3428; CHEBI:13948; CHEBI:23040

H-Beta-Ala-His-OH

L-Carnosine, 98%

MFCD00005207

N(alpha)-(beta-alanyl)-L-histidinate; carnosinate anion; carnosinate(1-)

N-beta-Alanyl-L-histidine

N-beta-alanyl-L-histidine; carnosine; ignotine

OR-0959

Polaprezinc

Promac

Z-103

Zinc Carnosine

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) -3.70 1.56 -107.24 6 7 1 127 227.244 6 ↓
Hi High (pH 8-9.5) -3.51 -2.04 -54.11 4 7 -1 127 225.228 6 ↓
Hi High (pH 8-9.5) -3.51 -2.55 -59.07 4 7 -1 127 225.228 6 ↓
Hi High (pH 8-9.5) -3.51 -2.03 -61.96 4 7 -1 127 225.228 6 ↓
Hi High (pH 8-9.5) -3.51 -2.99 -53.81 4 7 -1 127 225.228 6 ↓
Mid Mid (pH 6-8) -3.51 -2.24 -78.17 5 7 0 129 226.236 6 ↓
Mid Mid (pH 6-8) -3.51 -1.65 -76.1 5 7 0 129 226.236 6 ↓
Mid Mid (pH 6-8) -3.51 -1.69 -86.89 5 7 0 129 226.236 6 ↓
Mid Mid (pH 6-8) -3.70 0.94 -84.58 5 7 0 126 226.236 6 ↓
Mid Mid (pH 6-8) -3.51 -2.61 -77.6 5 7 0 129 226.236 6 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 253 Acros Organics
Purity 95% Fluorochem
UniProt Database Links CNDP1_HUMAN; CNDP1_MOUSE; CNDP1_RAT; CNDP2_BOVIN; CNDP2_HUMAN; CNDP2_MOUSE; CNDP2_PONAB; CNDP2_RAT; CRNS1_CHICK; CRNS1_HUMAN; CRNS1_MOUSE; PEPV_LACDL ChEBI
Patent Database Links EP1586332; EP1752131; EP1860116; EP1867323; EP1932514; EP1938810; EP1949906; GB2107584; US2007196296; US2007196511; US2007224272; US2007224294; US2007231371; US2008234344; WO2005092850 ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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