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Phenethicillin potassium

CAT: 0931-T24630-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T24630-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
132-93-4
Target
Others, Antibacterial
Related Pathways
Microbiology/Virology, Others
Bioactivity
Phenethicillin potassium is a potassium salt form of phenethicillin with antibacterial activity.
Smiles
[K].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C(C)Oc1ccccc1)C(O)=O
Molecular Formula
C17H20KN2O5S
Molecular Weight
403.51
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Phenethicillin Potassium

Phenethicillin potassium is an organic potassium salt. It contains a phenethicillin(1-).

CAS Number132-93-4
PubChem CID23675317
IUPAC Namepotassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Molecular FormulaC17H19KN2O5S
Molecular Weight402.5
Topological Polar Surface Area124
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity582
SMILES
CC(C(=O)N[C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)[O-])OC3=CC=CC=C3.[K+]
InChI
InChI=1S/C17H20N2O5S.K/c1-9(24-10-7-5-4-6-8-10)13(20)18-11-14(21)19-12(16(22)23)17(2,3)25-15(11)19;/h4-9,11-12,15H,1-3H3,(H,18,20)(H,22,23);/q;+1/p-1/t9?,11-,12+,15-;/m1./s1
InChIKey
ORMNNUPLFAPCFD-DVLYDCSHSA-M
Chemical Structure
2D Structure
2D structure of Phenethicillin Potassium
CAS: 132-93-4
CID: 23675317
Formula: C17H19KN2O5S
MW: 402.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight402.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass402.06517437
Monoisotopic Mass402.06517437
Topological Polar Surface Area124 Ų
Heavy Atom Count26
Formal Charge0
Complexity582
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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HY-W743292Phenethicillin (sodium) -d5
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