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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid,7-((5-amino-5-carboxy-1-oxopentyl)amino)-3-(hydroxymethyl)-7-methoxy-, monosodium salt, (6R-(6alpha,7beta(R*)))-
RN: 81517-91-1
InChIKey: LQCWMZOBDLQQBP-YTXFTZFESA-M

Molecular Formula

  • C15-H23-N3-O7-S.Na

Molecular Weight

  • 411.409
 
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Names and Synonyms

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid,7-((5-amino-5-carboxy-1-oxopentyl)amino)-3-(hydroxymethyl)-7-methoxy-, monosodium salt, (6R-(6alpha,7beta(R*)))-

Registry Numbers

CAS Registry Number

  • 81517-91-1

System Generated Number

  • 0081517911

Molecular Formulas

Molecular Formula

  • C15-H23-N3-O7-S.Na

Molecular Formula Fragments

  • C15-H23-N3-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C15H23N3O7S.Na/c1-25-15(17-10(20)4-2-3-9(16)12(21)22)7-18-11(13(23)24)8(5-19)6-26-14(15)18;/h9,14,19H,2-7,16H2,1H3,(H,17,20)(H,21,22)(H,23,24);/q;+1/p-1/t9?,14-,15-;/m1./s1

InChIKey

LQCWMZOBDLQQBP-YTXFTZFESA-M

Smiles

[Na+].N12C(=C(CS[C@@H]2[C@@](C1)(OC)NC(CCC[C@@H](C(=O)O)N)=O)CO)C(=O)[O-]