Sulbenicillin sodium

CAS Registry Number®

28002-18-8
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CAS Name

Sulbenicillin sodium

Molecular Formula

C16H18N2O7S2.2Na

Cite this Page

Sulbenicillin sodium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28002-18-8 (retrieved 2024-04-28) (CAS RN: 28002-18-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H18N2O7S2.2Na/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

InChIKey

InChIKey=IGNODAGFTVBLTL-HCIBPFAFSA-N

SMILES

C(O)(=O)[C@@H]1N2[C@@]([C@H](NC(C(S(=O)(=O)O)C3=CC=CC=C3)=O)C2=O)(SC1(C)C)[H].[Na]

Canonical SMILES

[Na].O=C(O)C1N2C(=O)C(NC(=O)C(C=3C=CC=CC3)S(=O)(=O)O)C2SC1(C)C

Other Names for this Substance

  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(2-phenyl-2-sulfoacetyl)amino]-, sodium salt (1:2), (2S,5R,6R)-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(2-phenyl-2-sulfoacetamido)-, disodium salt
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylsulfoacetyl)amino]-, disodium salt, [2S-(2α,5α,6β)]-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylsulfoacetyl)amino]-, disodium salt, (2S,5R,6R)-
  • Sulfocillin

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Deleted or Replaced CAS Registry Numbers

34781-54-9, 34861-62-6

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