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Basic information
- CAS
1955-68-6- Standard SMILES
NC(CC(=O)NO)C(=O)O- InChIKey
ZBYVTTSIVDYQSO-UHFFFAOYSA-N- Molecular formula
- C4H8N2O4
- Average molar mass
- 148.12 g/mol
Overview
RN given refers to (DL)-isomer
Names & identifiers
- Preferred name
- beta-Aspartylhydroxamic acid
- IUPAC
- 2-amino-4-(hydroxyamino)-4-oxobutanoic acid
- English name
- L-Aspartic acid beta-hydroxamate
- Molecular formula
- C4H8N2O4
- Molecular weight
- 148.12
Names & synonyms
beta-Aspartylhydroxamic acidDL-Asparagine, N-hydroxy-20154-32-9RefChem:119210beta-Aspartylhydroxamate2-Amino-4-(hydroxyamino)-4-oxobutanoic acidAspartate-beta-hydroxamateAspartic acid beta-hydroxamateNSC 528507D-Aspartic acid beta-hydroxamate3-alaninehydroxamic acidCHEMBL216856
Show more names
AAHl-aspartic acid β-hydroxamateHDXN4-Hydroxy-L-asparagineL-Asparagine, N-hydroxy-L-β-Aspartohydroxamic acidL-ASPARTICACIDβ-HYDROXAMATEL-Aspartyl-?-hydroxamic acid3-(Hydroxycarbamoyl)-L-alanine
SCHEMBL9684668ZBYVTTSIVDYQSO-UHFFFAOYSA-NDAHNSC141662NSC528507NSC-141662NSC-528507
Database identifiers
- CAS
1955-68-6、20154-32-9- PubChem CID
- 65274
- ChEMBL
CHEMBL216856
Properties
Computed structural propertiesFilling in
- XLogP
- -3.5
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 146
Physicochemical properties
- Melting point
- 171 · 171-172 °C
- Density
- 1.532 · 1.532±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 3.02 · 3.02±0.10(Predicted)
- form
- Solid
- color
- White to off-white
- Major Application
- detection
- InChI
- 1S/C4H8N2O4/c5-2(4(8)9)1-3(7)6-10/h2,10H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
- InChIKey
- ZBYVTTSIVDYQSO-REOHCLBHSA-N
- SMILES
- N[C@@H](CC(=O)NO)C(O)=O
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 26 · NA.26
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Substances that inhibit or prevent the proliferation of NEOPLASMS.
Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly.
Applications
DescriptionHydroxylated lecithin, also known as b-L-aspartylhydroxamate or b-aspartohydroxamic acid, belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom. Based on a literature review a small amount of articles have been published on Hydroxylated lecithin.
UsesL-ASPARTIC ACID BETA-HYDROXAMATE can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical and pharmaceutical production process.
Suppliers21 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
河北展药生物科技有限公司15369953316 +8615369953316 · [email protected]
Aladdin Scientific[email protected]
Syntechem Co.,Ltd[email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
Hebei Shengyuan Jinlong Import and Export Co. LTD
Related reactions
1 records
Compound notes
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