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Beta-Alanylhistidine

HCID 9369
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
108333-82-0
Standard SMILES
NCCC(=O)NC(Cc1cnc[nH]1)C(=O)O
InChIKey
CQOVPNPJLQNMDC-UHFFFAOYSA-N
Molecular formula
C9H14N4O3
Average molar mass
226.23 g/mol
Monoisotopic mass
226.10659032

Overview

See also: Malate Dehydrogenase (annotation moved to); Carnosine (annotation moved to); Malate dehydrogenase (NAD) (annotation moved to) ... View More ...

Names & identifiers

Preferred name
Beta-Alanylhistidine
IUPAC
2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid
English name
Ribonuclease A
Molecular formula
NULL
Molecular weight
0

Names & synonyms

108333-82-0beta-AlanylhistidineDTXSID50861860RefChem:1079608DTXCID902042779001-99-4Ribonuclease ARIBONUCLEASEDL-(3-aminopropanoyl)histidineribonuclease A from bovine pancreas2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid2-(3-aminopropanamido)-3-(1H-imidazol-5-yl)propanoic acid
Show more names
RNASE ARNASERIBONUCLEASE BRP-1RNAaseRnase IRNAase AS-RNaseabs9330
B-Ala-his-ohNuclease, ribo-L-Histidine, N-.beta.-alanyl-2-(3-aminopropanoylamino)-3-(3H-imidazol-4-yl)propanoic acidbeta-ALA-HISEC-Alanyl-L-histidine|A-Alanyl-L-histidineRNase A,bovine pancreas

Database identifiers

CAS
108333-82-0、305-84-0、9001-99-4
PubChem CID
9369
DTXSID
DTXSID50861860
ChEMBL
CHEMBL18545

Properties

Computed structural properties

XLogP
-4
Topological polar surface area
121 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
16
Formal charge
0
Complexity
259

Experimental & physicochemical properties

Chemical ClassesBiological Agents -> Enzymes
Physical DescriptionSolid; [Merck Index] Powder; [Sigma-Aldrich MSDS]

Physicochemical properties

Melting point
243 °C · 243 °C (dec.)
alpha
25 · D25 (per mg N) -0.47° (c = 5)
storage temp.
-20 °C · -20°C
solubility
10 mM · Reconstitute in 10mM acetate, pH 5.0 with or without 15mM calcium chloride
form
solid
color
white
PH
8 · pH : 8.0
biological source
protein from bovine pancreas
Water Solubility
Soluble in water.
Sensitive
Moisture Sensitive
Specific Activity
85 · 85-140Kunitz units/mg protein

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H334 (98.3%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]

P233, P260, P271, P284, P304+P340, P342+P316, P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 175 reports by companies from 4 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 2 items

XU - indicates a substance exempt from reporting under the Chemical Data Reporting Rule, (40 CFR 711).

Nuclease, ribo-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryMay cause irritation; May cause allergic reactions in sensitive individuals; [Sigma-Aldrich MSDS] See ENZYMES.
Hazard Classes and CategoriesResp. Sens. 1 (98.3%)

Safety data

F
10-21
PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
rtecs
RF0760000
hs_code
35079090
Signal word
Danger
Symbol(GHS)
GHS08
safety_code
22-24/25
Storage Class
11 - Combustible Solids

Chemistry & industry

Uses & manufacturing

UsesEnzyme that breaks down RNA; [Merck Index]
General Manufacturing InformationRibonuclease: ACTIVE
Applications · 3 items

UsesRibonuclease A (RNase A) is a pancreatic ribonuclease that cleaves single-stranded RNA. RNase A, and several homologs, may be useful as cancer therapeutics due to their cytotoxic effects on cancer cells. Rnase A is useful in the elucidation of protein structure and absorbance. RNase A has been used as a model system in the study of computer-aided drug design . Product R2638 has scrambled disulfide bonds and is from bovine pancreas.

UsesRibonuclease A is used to remove RNA from DNA plasmid preparations and protein samples. Ribonuclease A is used for RNase protection assays, to remove unspecifically bound RNA, analysis of RNA sequences, to hydrolyze RNA contained in protein samples, and the purification of DNA. Ribonuclease A from bovine pancreas has been used in a study to assess the mechanism of heavy metal ions on RNase activity. Ribonuclease A from bovine pancreas has also been used in a study to investigate the performance of oligomeric poly(diallyldimethylammonium chloride) as displacer for cation-exchange displacement chromatography of proteins.

General DescriptionHuman chromosome 14q11.2 shows the presence of all human RNases. Only eight (RNase 1-8) of them were true called as canonical RNases. And the rest nine to thirteen are called as noncanonical RNases. Human RNase 1 is called as HP-RNase or human pancreatic RNase. Human RNase 2 is also called as EDN (eosinophils derived neurotoxin) that is isolated from eosinophils.

Upstream & downstream products

Upstream raw materials

ErythromycinAmmonium sulfate

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
EC Number
232-646-6
Major Application
diagnostic assay manufacturing
InChI
1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)
InChIKey
CQOVPNPJLQNMDC-UHFFFAOYSA-N
SMILES
[nH]1cnc(c1)CC(NC(=O)CCN)C(=O)O
EWG's Food Scores
1 · 1
EPA Substance Registry System
Nuclease, ribo- (9001-99-4)
UNSPSC Code
12352204 · 12352204
NACRES
54 · NA.54
Symbol(GHS)
8 · GHS08
Signal word
Danger
Hazard statements
334 · H334
Precautionary statements
261 · P261-P284-P501
PPE
95 · Eyeshields, Gloves, type N95 (US)
Safety Statements
22 · 22-24/25
WGK Germany
3 · 3
RTECS
760000 · RF0760000
F
10 · 10-21
TSCA
TSCA listed
HS Code
35079090 · 35079090
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
1 · Resp. Sens. 1
Hazard statements
H334
Hazard Classifications
Resp. Sens. 1
Precautionary statements
P261-P284-P501