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Substance Name: A1-226
RN: 59684-59-2
InChIKey: BMYHQZVYLLQHKO-KCOKAVLFSA-N

Molecular Formula

  • C16-H16-N2-O5-S

Molecular Weight

  • 348.3774
 
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Names and Synonyms

Name of Substance

  • A1-226

Synonyms

  • 7-(alpha-Hydroxy-alpha-phenylacetamido)-3-methyl-3-cephem-4-carboxylic acid
  • A 1226

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((hydroxyphenylacetyl)amino)-3-methyl-8-oxo-, monopotassium salt, (6R-(6alpha,7beta(R*)))-

Registry Numbers

CAS Registry Number

  • 59684-59-2

System Generated Number

  • 0059684592

Structure Descriptors

InChI

1S/C16H16N2O5S/c1-8-7-24-15-10(14(21)18(15)11(8)16(22)23)17-13(20)12(19)9-5-3-2-4-6-9/h2-6,10,12,15,19H,7H2,1H3,(H,17,20)(H,22,23)/t10-,12?,15-/m1/s1

InChIKey

BMYHQZVYLLQHKO-KCOKAVLFSA-N

Smiles

CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(O)c3ccccc3)C2=O)C(=O)O