chempirical

Penicillin G potassium

C16H17KN2O4SCAS 113-98-4372.48 g/mol

Open in Covalent MOL file
SNHOONO−OK+
AmideCarboxylic acidLactamSulfide

Properties

Molecular formula
C16H17KN2O4S
Molar mass
372.48 g/mol
Exact mass
372.0546 Da
Melting point
214–217 °C (decomposes)
logP
1.32Crippen estimate
Polar surface area
90.2 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
4
Stereocentres
R, R, Sin SMILES atom order

Identifiers

CAS number
113-98-4
SMILES
CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C([O-])=O.[K+]
InChIKey
OXYXVSUHBSRMFJ-LQDWTQKMSA-N
InChI
InChI=1S/C16H18N2O4S.K/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);/t11-,12+,14-;/m1./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

33 names · show all
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]- (2S,5R,6R)-, potassium salt (1:1)
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-, monopotassium salt
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-[2S-(2α,5α,6β)]-, monopotassium salt
  • Penicillin G, potassium salt
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]- (2S,5R,6R)-, monopotassium salt
  • Benzylpenicillinic acid potassium salt
  • Benzylpenicillin potassium
  • Benzylpenicillin potassium salt
  • Eskacillin
  • Falapen
  • Hipercilina
  • Notaral
  • Pentids
  • Potassium benzylpenicillin
  • Potassium benzylpenicillinate
  • Potassium penicillin G
  • Tabilin
  • Potassium 2,2-dimethyl-6β-phenylacetamidopenam-3α-carboxylate
  • Forpen
  • Hylenta
  • Hyasorb
  • Cristapen
  • Monopen
  • Megacillin tablets
  • Scotcil
  • Potassium 6-(phenylacetamido)penicillanate
  • Novocillin vet.
  • Cosmopen
  • M-Cillin
  • Pentid
  • Crytapen
  • NSC 131815
  • Pfizerpen

Work with Penicillin G potassium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Penicillin G sodium69-57-891 % similar Penicillin V potassium132-98-977 % similar Carbenicillin disodium4800-94-661 % similar Ampicillin sodium69-52-359 % similar Sulbenicillin sodium28002-18-857 % similar Methicillin sodium132-92-354 % similar Azlocillin sodium37091-65-953 % similar Oxacillin sodium1173-88-253 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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