Sulbactam sodium

CAT: 0127-BUP16674-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP16674-01Size:100 mg

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CAS Number

69388-84-7

Synonyms

CP-45899-2

Purity

=98%

Smiles

[Na+].[H][C@@]12CC(=O)N1[C@@]([H])(C([O-])=O)C(C)(C)S2(=O)=O

Chemical Information

Sulbactam Sodium

Sulbactam sodium is the organic sodium salt of sulbactam. It is a beta-lactam antibiotic and an organic sodium salt. It contains a sulbactam(1-).

CAS Number	69388-84-7
PubChem CID	23663973
IUPAC Name	sodium (2S,5R)-3,3-dimethyl-4,4,7-trioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Molecular Formula	C8H10NNaO5S
Molecular Weight	255.23
Topological Polar Surface Area	103
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	16
Formal Charge	0
Complexity	452

SMILES

CC1([C@@H](N2[C@H](S1(=O)=O)CC2=O)C(=O)[O-])C.[Na+]

InChI

InChI=1S/C8H11NO5S.Na/c1-8(2)6(7(11)12)9-4(10)3-5(9)15(8,13)14;/h5-6H,3H2,1-2H3,(H,11,12);/q;+1/p-1/t5-,6+;/m1./s1

InChIKey

NKZMPZCWBSWAOX-IBTYICNHSA-M

Chemical Structure

2D Structure

CAS: 69388-84-7

CID: 23663973

Formula: C8H10NNaO5S

MW: 255.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	255.23
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	255.01773788
Monoisotopic Mass	255.01773788
Topological Polar Surface Area	103 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	452
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
BUP14917-01	Sulbactam
BUP06683-01	Sulbactum Sodium
IN3250	Sodium
OR1042867-01	Dikegulac sodium
OR1078904-01	Sodium Octanohydroxamate
OR1078862-01	Ozagrel Sodium
OR1078125	Bispyribac Sodium
PC109267-01	Pantoprazole sodium
PC109203-01	Sodium Perflurononyloxybenzenesulfonate
PC109083-01	Sodium Fluoromethanesulfinate