Chem
J-GLOBAL ID：200907035838787353   Nikkaji number：J1.197.307H

3-(Acetoxymethyl)-7-[[(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]cepham-3-ene-4-carboxylic acid tert-butyl ester

3-(アセトキシメチル)-7-[[(2-アミノ-4-チアゾリル)(メトキシイミノ)アセチル]アミノ]セファム-3-エン-4-カルボン酸tert-ブチル
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： C20H25N5O7S2
Molecular formula furigana： C20-H25-N5-O7-S2
Molecular weight： 511.570
InChI： InChI=1S/C20H25N5O7S2/c1-9(26)31-6-10-7-33-17-13(16(28)25(17)14(10)18(29)32-20(2,3)4)23-15(27)12(24-30-5)11-8-34-19(21)22-11/h8,13,17H,6-7H2,1-5H3,(H2,21,22)(H,23,27)/t13?,17-/m1/s1
InChI key： QYWRPAMZVWYMFW-LRHAYUFXSA-N
SMILES： CON=C(C(=O)NC1[C@H]2SCC(=C(N2C1=O)C(=O)OC(C)(C)C)COC(=O)C)c1csc(N)n1
Systematic name  (3)：
  • 3-(アセトキシメチル)-7-[[(2-アミノ-4-チアゾリル)(メトキシイミノ)アセチル]アミノ]セファム-3-エン-4-カルボン酸tert-ブチル
  • tert-ブチル (6R)-3-[(アセチルオキシ)メチル]-7-[2-(2-アミノ-1,3-チアゾール-4-イル)-2-(メトキシイミノ)アセトアミド]-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
  • tert-butyl (6R)-3-[(acetyloxy)methyl]-7-[2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Other name (1)：
  • 3-(Acetoxymethyl)-7-[[(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]cepham-3-ene-4-carboxylic acid tert-butyl ester
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