Azthreonam dipotassium salt
Basic information
- CAS
80581-95-9- Standard SMILES
C[C@H]1[C@@H](NC(=O)/C(=N\OC(C)(C)C(=O)O)c2csc(N)n2)C(=O)N1S(=O)(=O)[O-].[K+].[K+]- InChIKey
DPVIIOBRGPBWBC-IWCLDPMRSA-M- Molecular formula
- C13H16K2N5O8S2+
- Average molar mass
- 512.6 g/mol
- Monoisotopic mass
- 511.9714428
Names & identifiers
- Preferred name
- Azthreonam dipotassium salt
- IUPAC
- dipotassium;(2S,3R)-3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-2-methyl-4-oxoazetidine-1-sulfonate
- English name
- Propanoic acid, 2-[[[1-(2-amino-4-thiazolyl)-2-[(2-methyl-4-oxo-1-sulfo-3-azetidinyl)amino]-2-oxoethylidene]amino]oxy]-2-methyl-, dipotassium salt, [2S-[2α,3β(Z)]]- (9CI)
- Molecular formula
- C13H18KN5O8S2
- Molecular weight
- 475.53
Names & synonyms
80581-95-9Azthreonam dipotassium saltdipotassium;(2S,3R)-3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-2-methyl-4-oxoazetidine-1-sulfonatePropanoic acid, 2-(((1-(2-amino-4-thiazolyl)-2-((2-methyl-4-oxo-1-sulfo-3-azetidinyl)amino)-2-oxoethylidene)amino)oxy)-2-methyl-, dipotassium salt, (2S-(2alpha,3beta(Z)))-Propanoic acid, 2-[[[1-(2-amino-4-thiazolyl)-2-[(2-methyl-4-oxo-1-sulfo-3-azetidinyl)amino]-2-oxoethylidene]amino]oxy]-2-methyl-, dipotassium salt, [2S-[2α,3β(Z)]]- (9CI)
Database identifiers
- CAS
80581-95-9- PubChem CID
- 9577243
Properties
Computed structural properties
- Topological polar surface area
- 241 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 1
- Complexity
- 795
Chemistry & industry
Applications
DescriptionAzthreonam dipotassium salt is a synthetic monobactam which targets gram-negative bacteria.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…