4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[[(2R)-2-(methyleneamino)-2-phenylacetyl]amino]-7-oxo-, sodium salt (1:1), (2S,5R,6R)-

CAS Registry Number®

6489-61-8

CAS Name

4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[[(2R)-2-(methyleneamino)-2-phenylacetyl]amino]-7-oxo-, sodium salt (1:1), (2S,5R,6R)-

Molecular Formula

C17H19N3O4S.Na

Cite this Page

4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[[(2R)-2-(methyleneamino)-2-phenylacetyl]amino]-7-oxo-, sodium salt (1:1), (2S,5R,6R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6489-61-8 (retrieved 2024-11-22) (CAS RN: 6489-61-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H19N3O4S.Na/c1-17(2)12(16(23)24)20-14(22)11(15(20)25-17)19-13(21)10(18-3)9-7-5-4-6-8-9;/h4-8,10-12,15H,3H2,1-2H3,(H,19,21)(H,23,24);/t10-,11-,12+,15-;/m1./s1

InChIKey

InChIKey=VWPWVQSRUCQFIL-GKANRWTBSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[[(2R)-2-(methyleneamino)-2-phenylacetyl]amino]-7-oxo-, sodium salt (1:1), (2S,5R,6R)-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[2-(methyleneamino)-2-phenylacetamido]-7-oxo-, monosodium salt, D-(-)-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[[(methyleneamino)phenylacetyl]amino]-7-oxo-, monosodium salt, [2S-[2α,5α,6β(S*)]]-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-6-[[(2R)-(methyleneamino)phenylacetyl]amino]-7-oxo-, monosodium salt, (2S,5R,6R)-
  • Methyleneampicillin sodium salt

View All

Deleted or Replaced CAS Registry Numbers

34827-46-8, 55710-68-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration