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Clavulanate:Cellulose

CAT: 0127-BIC581-01Size: 1 gDry Ice: NoHazardous: No
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CAS Number
61177-45-5
Synonyms
Clavulanic acid potassium salt:Cellulose (1:1)
MDL Number
MFCD01710901
Smiles
[K+].OC\C=C\1/O[C@@H]2CC(=O)N2[C@H]1C(=O)[O-]
Additionnal Information
Store at 2-8°C
Storage Conditions
Store at 2-8°C

Chemical Information

Potassium Clavulanate

Potassium clavulanate is a potassium salt having clavulanate as the counterion. It acts as a suicide inhibitor of bacterial beta-lactamase enzymes and has only weak anitbiotic activity when administered alone. However it can be used in combination with amoxicillin trihydrate (under the trade name Augmentin) for treatment of a variety of bacterial infections, where it prevents antibiotic inactivation by microbial lactamases. It has a role as an antimicrobial agent, an EC 3.5.2.6 (beta-lactamase) inhibitor and an antibacterial drug. It contains a clavulanate.

CAS Number61177-45-5
PubChem CID23665591
IUPAC Namepotassium (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
Molecular FormulaC8H8KNO5
Molecular Weight237.25
Topological Polar Surface Area89.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity329
SMILES
C1[C@@H]2N(C1=O)[C@H](/C(=C/CO)/O2)C(=O)[O-].[K+]
InChI
InChI=1S/C8H9NO5.K/c10-2-1-4-7(8(12)13)9-5(11)3-6(9)14-4;/h1,6-7,10H,2-3H2,(H,12,13);/q;+1/p-1/b4-1-;/t6-,7-;/m1./s1
InChIKey
ABVRVIZBZKUTMK-JSYANWSFSA-M
Chemical Structure
2D Structure
2D structure of Potassium Clavulanate
CAS: 61177-45-5
CID: 23665591
Formula: C8H8KNO5
MW: 237.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight237.25
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass237.00395384
Monoisotopic Mass237.00395384
Topological Polar Surface Area89.9 Ų
Heavy Atom Count15
Formal Charge0
Complexity329
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes