Products 94659-48-0

CAS 94659-48-0 is the registry number for Ampicillin Trimer Sodium Salt. Offered by: TRC. Available pack sizes: 10mg, 1mg, 2,5mg.

Ampicillin Trimer Sodium Salt
TRC
  • size: 10mg, 1mg, 2,5mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

Trisodium;(2S,5R,6R)-6-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[2-[[(2R)-2-amino-2-phenylacetyl]amino]-2-[(2R,4S)-4-carboxylato-5,5-dimethyl-1,3-thiazolidin-2-yl]acetyl]amino]-2-phenylacetyl]amino]-2-[(2S,4S)-4-carboxylato-5,5-dimethyl-1,3-thiazolidin-2-yl]acetyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (CAS 94659-48-0) is a chemical compound with the molecular formula C48H54N9Na3O12S3 and a molecular weight of 1114.2 g/mol. IUPAC name: trisodium;(2S,5R,6R)-6-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[2-[[(2R)-2-amino-2-phenylacetyl]amino]-2-[(2R,4S)-4-carboxylato-5,5-dimethyl-1,3-thiazolidin-2-yl]acetyl]amino]-2-phenylacetyl]amino]-2-[(2S,4S)-4-carboxylato-5,5-dimethyl-1,3-thiazolidin-2-yl]acetyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate. InChIKey: MVRYVEHZNLUAGV-KVNZOJBASA-K.

Identity
Molecular formulaC48H54N9Na3O12S3
Molecular weight1114.2 g/mol
IUPAC nametrisodium;(2S,5R,6R)-6-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[2-[[(2R)-2-amino-2-phenylacetyl]amino]-2-[(2R,4S)-4-carboxylato-5,5-dimethyl-1,3-thiazolidin-2-yl]acetyl]amino]-2-phenylacetyl]amino]-2-[(2S,4S)-4-carboxylato-5,5-dimethyl-1,3-thiazolidin-2-yl]acetyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
InChIKeyMVRYVEHZNLUAGV-KVNZOJBASA-K
SMILESCC1([C@@H](N[C@@H](S1)[C@@H](C(=O)N[C@H](C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-])NC(=O)[C@@H](C5=CC=CC=C5)NC(=O)C([C@@H]6N[C@H](C(S6)(C)C)C(=O)[O-])NC(=O)[C@@H](C7=CC=CC=C7)N)C(=O)[O-])C.[Na+].[Na+].[Na+]

Computed by PubChem (NCBI)

Synonyms: Ampicillin Trimer Sodium Salt(>80%)