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
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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.NaCite 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 ) (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
Deleted or Replaced CAS Registry Numbers
34827-46-8, 55710-68-4
