Chem
J-GLOBAL ID:200907017981206118   Nikkaji number:J1.367.641K

(6R,7R)-3-[2-(3-Methoxyisothiazole-5-yl)ethenyl]-7-[2-(2-amino-5-chlorothiazole-4-yl)-2-(hydroxyimino)acetylamino]cepham-3-ene-4-carboxylic acid sodium salt

(6R,7R)-3-[2-(3-メトキシイソチアゾール-5-イル)エテニル]-7-[2-(2-アミノ-5-クロロチアゾール-4-イル)-2-(ヒドロキシイミノ)アセチルアミノ]セファム-3-エン-4-カルボン酸ナトリウム
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C18H14ClN6NaO6S3
Molecular formula furigana: C18-H14-CL-N6-NA-O6-S3
Molecular weight: 564.970
InChI: InChI=1S/C18H15ClN6O6S3.Na/c1-31-8-4-7(34-24-8)3-2-6-5-32-16-11(15(27)25(16)12(6)17(28)29)21-14(26)10(23-30)9-13(19)33-18(20)22-9;/h2-4,11,16,30H,5H2,1H3,(H2,20,22)(H,21,26)(H,28,29);/q;+1/p-1/t11-,16-;/m1./s1
InChI key: UCOOJJYSMCBZQX-INXKOZGQSA-M
SMILES: COc1cc(C=CC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=NO)c2nc(N)sc2Cl)C3=O)C(=O)O[Na])sn1
Systematic name  (3):
  • (6R,7R)-3-[2-(3-メトキシイソチアゾール-5-イル)エテニル]-7-[2-(2-アミノ-5-クロロチアゾール-4-イル)-2-(ヒドロキシイミノ)アセチルアミノ]セファム-3-エン-4-カルボン酸ナトリウム
  • ナトリウム (6R,7R)-7-[2-(2-アミノ-5-クロロ-1,3-チアゾール-4-イル)-2-(N-ヒドロキシイミノ)アセトアミド]-3-[2-(3-メトキシ-1,2-チアゾール-5-イル)エテニル]-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-2-カルボキシラート
  • sodium (6R,7R)-7-[2-(2-amino-5-chloro-1,3-thiazol-4-yl)-2-(N-hydroxyimino)acetamido]-3-[2-(3-methoxy-1,2-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Other name (1):
  • (6R,7R)-3-[2-(3-Methoxyisothiazole-5-yl)ethenyl]-7-[2-(2-amino-5-chlorothiazole-4-yl)-2-(hydroxyimino)acetylamino]cepham-3-ene-4-carboxylic acid sodium salt
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