1.0 2026-03-31 20:42:58 UTC 2026-08-28 18:58:57 UTC D-(-)-Sulbenicillin SmallMolecule D-(-)-Sulbenicillin is an organic compound with the formula C16H18N2O7S2 and an average molecular weight of 414.45 g/mol. D-(-)-Sulbenicillin belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This substance is found in or released from one recorded source: healthcare, pharmaceuticals & veterinary products (Antibiotics). Recorded exposure routes for the compound include inhalation and oral administration. (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-((R)-2-phenyl-2-sulfoacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-1-oxo-2-phenyl-2-sulfoethyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-2-phenyl-2-sulfo-acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-2-phenyl-2-sulfo-ethanoyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-2-phenyl-2-sulfoacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-7-keto-3,3-dimethyl-6-[[(2R)-2-phenyl-2-sulfo-acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 255-528-6 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[[(2R)-2-phenyl-2-sulfoacetyl]amino]-, (2S,5R,6R)- a-Sulfobenzylpenicillin Kedacillina MFCD00869408 sulbenicillin Sulbenicillin Sodium Sulfocillin UNII-Q2VYF0562D UNII:Q2VYF0562D [2S-[2a,5a,6b(S*)]]-3,3-Dimethyl-7-oxo-6-[(phenylsulfoacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid [41744-40-5] C16H18N2O7S2 414.45 414.055542 (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2R)-2-phenyl-2-sulfoacetamido]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2R)-2-phenyl-2-sulfoacetamido]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 41744-40-5;12772-42-8 [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@@H](C1=CC=CC=C1)S(O)(=O)=O)C(O)=O InChI=1S/C16H18N2O7S2/c1-16(2)11(15(21)22)18-13(20)9(14(18)26-16)17-12(19)10(27(23,24)25)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,17,19)(H,21,22)(H,23,24,25)/t9-,10-,11+,14-/m1/s1 JETQIUPBHQNHNZ-NJBDSQKTSA-N Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues N-acyl-alpha amino acids and derivatives Alkanesulfonic acids Azacyclic compounds Azetidines Benzene and substituted derivatives Carbonyl compounds Carboximidic acids Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Organosulfonic acids Penams Propargyl-type 1,3-dipolar organic compounds Sulfonyls Tertiary carboxylic acid amides Thiazolidines Thiohemiaminal derivatives Alkanesulfonic acid Aromatic heteropolycyclic compound Azacycle Azetidine Benzenoid Beta-lactam Carbonyl group Carboxamide group Carboximidic acid Carboximidic acid derivative Carboxylic acid Dialkylthioether Hemithioaminal Hydrocarbon derivative Lactam Monocarboxylic acid or derivatives Monocyclic benzene moiety N-acyl-alpha amino acid or derivatives Organic 1,3-dipolar compound Organic nitrogen compound Organic oxide Organic oxygen compound Organic sulfonic acid or derivatives Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organosulfonic acid Organosulfonic acid or derivatives Organosulfur compound Penam Propargyl-type 1,3-dipolar organic compound Sulfonyl Tertiary carboxylic acid amide Thiazolidine Thioether Aromatic heteropolycyclic compounds Detected and Not Quantified logp 0.38 logp -0.20 ALOGPS logs -2.75 ALOGPS solubility 7.41e-01 g/l ALOGPS logp 0.38 ChemAxon pka_strongest_acidic -1.1 ChemAxon pka_strongest_basic -6.4 ChemAxon iupac (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2R)-2-phenyl-2-sulfoacetamido]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid ChemAxon average_mass 414.45 ChemAxon mono_mass 414.055542 ChemAxon smiles [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@@H](C1=CC=CC=C1)S(O)(=O)=O)C(O)=O ChemAxon formula C16H18N2O7S2 ChemAxon inchi InChI=1S/C16H18N2O7S2/c1-16(2)11(15(21)22)18-13(20)9(14(18)26-16)17-12(19)10(27(23,24)25)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,17,19)(H,21,22)(H,23,24,25)/t9-,10-,11+,14-/m1/s1 ChemAxon inchikey JETQIUPBHQNHNZ-NJBDSQKTSA-N ChemAxon polar_surface_area 141.08 ChemAxon refractivity 94.51 ChemAxon polarizability 37.98 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 7 ChemAxon donor_count 3 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bb3b6b908> DB13693 20055036 16736045