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Substance Name: Sodium (2S-(2alpha,5alpha,6beta(S*)))-6-((((3-methoxy-1-methyl-3-oxoprop-1-enyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate
RN: 64099-47-4
InChIKey: YOITVZNCTOLWBV-FIFSFEKOSA-M

Molecular Formula

  • C21-H25-N3-O6-S.Na

Molecular Weight

  • 469.4916
 
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Names and Synonyms

Synonym

  • EINECS 264-672-9

Systematic Name

  • Sodium (2S-(2alpha,5alpha,6beta(S*)))-6-((((3-methoxy-1-methyl-3-oxoprop-1-enyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate

Registry Numbers

CAS Registry Number

  • 64099-47-4

System Generated Number

  • 0064099474

Molecular Formulas

Molecular Formula

  • C21-H25-N3-O6-S.Na

Molecular Formula Fragments

  • C21-H25-N3-O6-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H25N3O6S.Na/c1-11(10-13(25)30-4)22-14(12-8-6-5-7-9-12)17(26)23-15-18(27)24-16(20(28)29)21(2,3)31-19(15)24;/h5-10,14-16,19,22H,1-4H3,(H,23,26)(H,28,29);/q;+1/p-1/b11-10+;/t14?,15-,16+,19-;/m1./s1

InChIKey

YOITVZNCTOLWBV-FIFSFEKOSA-M

Smiles

C/C(=C\C(=O)OC)/NC(c1ccccc1)C(=O)N[C@H]2[C@@H]3N(C2=O)[C@H](C(S3)(C)C)C(=O)[O-].[Na+]