Carbenicillin disodium

CAS Registry Number®

4800-94-6
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CAS Name

Carbenicillin disodium

Molecular Formula

C17H18N2O6S.2Na

Cite this Page

Carbenicillin disodium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4800-94-6 (retrieved 2024-04-28) (CAS RN: 4800-94-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H18N2O6S.2Na/c1-17(2)11(16(24)25)19-13(21)10(14(19)26-17)18-12(20)9(15(22)23)8-6-4-3-5-7-8;;/h3-7,9-11,14H,1-2H3,(H,18,20)(H,22,23)(H,24,25);;/t9?,10-,11+,14-;;/m1../s1

InChIKey

InChIKey=MYWJHWLQHFVZCY-YCAHSCEMSA-N

SMILES

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

Canonical SMILES

[Na].O=C(O)C(C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O)C=3C=CC=CC3

Other Names for this Substance

  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(2-carboxy-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-, sodium salt (1:2), (2S,5R,6R)-
  • Malonamic acid, N-(2-carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-6-yl)-2-phenyl-, disodium salt
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(carboxyphenylacetyl)amino]-3,3-dimethyl-7-oxo-, disodium salt, [2S-(2α,5α,6β)]-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(carboxyphenylacetyl)amino]-3,3-dimethyl-7-oxo-, disodium salt, (2S,5R,6R)-
  • BRL 2064

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Deleted or Replaced CAS Registry Numbers

131454-45-0, 21654-04-6, 26769-14-2, 41459-04-5, 50893-68-0, 52560-37-9

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