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Cefotetan disodium salt

CAT: 0957-E2881-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0957-E2881-01Size:5 mg
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Description
Cefotetan disodium salt is a semisynthetic cephamycin antibiotic that exerts its bactericidal effects by inhibition of cell-wall synthesis. It showed in vitro efficacy against ESBL-producing E.coli bloodstream isolates with MIC50 of 0.25 mg/L.
CAS Number
74356-00-6
Target
Others
Activity
Others
Molecular Formula
C17H17N7O8S4.2Na
Storage Conditions
3 years -20°C powder

Chemical Information

Cefotetan disodium

Cefotetan disodium is the disodium salt of cefotetan. It has a role as an antibacterial drug. It contains a cefotetan(2-).

CAS Number74356-00-6
PubChem CID53024
IUPAC Namedisodium;(6R,7S)-7-[[4-(2-amino-1-carboxylato-2-oxoethylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Molecular FormulaC17H15N7Na2O8S4
Molecular Weight619.6
Topological Polar Surface Area327
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count15
Rotatable Bond Count7
Heavy Atom Count38
Formal Charge0
Complexity1080
SMILES
CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)[O-])S4)OC)SC2)C(=O)[O-].[Na+].[Na+]
InChI
InChI=1S/C17H17N7O8S4.2Na/c1-23-16(20-21-22-23)34-4-5-3-33-15-17(32-2,14(31)24(15)7(5)11(29)30)19-9(26)13-35-12(36-13)6(8(18)25)10(27)28;;/h13,15H,3-4H2,1-2H3,(H2,18,25)(H,19,26)(H,27,28)(H,29,30);;/q;2*+1/p-2/t13?,15-,17+;;/m1../s1
InChIKey
ZQQALMSFFARWPK-ZTQQJVKJSA-L
Chemical Structure
2D Structure
2D structure of Cefotetan disodium
CAS: 74356-00-6
CID: 53024
Formula: C17H15N7Na2O8S4
MW: 619.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight619.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count15
Rotatable Bond Count7
Exact Mass618.96603372
Monoisotopic Mass618.96603372
Topological Polar Surface Area327 Ų
Heavy Atom Count38
Formal Charge0
Complexity1080
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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A19589-250Cefotetan disodium 250mg
A19589-50Cefotetan disodium 50mg
A19589-100Cefotetan disodium 100mg
A19589-1Cefotetan disodium 1mg
A19589-10Cefotetan disodium 10mg
A19589-5Cefotetan disodium 5mg

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