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Substance Name: Cephalosporin 112883
RN: 58801-40-4
InChIKey: DQBHNTJTWSHHTR-ZLXOECBPSA-N

Molecular Formula

  • C20-H22-N10-O5-S2

Molecular Weight

  • 546.5908
 
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Names and Synonyms

Name of Substance

  • Cephalosporin 112883

Synonyms

  • 112883
  • Guanylureidocephalosporin

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((((((aminoiminomethyl)amino)carbonyl)amino)phenylacetyl)amino)-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-(6alpha,7beta))-

Registry Numbers

CAS Registry Number

  • 58801-40-4

System Generated Number

  • 0058801404

Structure Descriptors

InChI

1S/C20H22N10O5S2/c1-29-20(26-27-28-29)37-8-10-7-36-16-12(15(32)30(16)13(10)17(33)34)23-14(31)11(9-5-3-2-4-6-9)24-19(35)25-18(21)22/h2-6,11-12,16H,7-8H2,1H3,(H,23,31)(H,33,34)(H5,21,22,24,25,35)/t11?,12-,16-/m1/s1

InChIKey

DQBHNTJTWSHHTR-ZLXOECBPSA-N

Smiles

Cn1c(nnn1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)C(c4ccccc4)NC(=O)NC(=N)N)SC2)C(=O)O