Chem
J-GLOBAL ID:200907024387889724   Nikkaji number:J1.066.538H

(7R)-3-(Acetoxymethyl)-7-hydroxy-7-(1-phenyl-2-propenyl)cepham-3-ene-4-carboxylic acid benzyl ester

(7R)-3-(アセトキシメチル)-7-ヒドロキシ-7-(1-フェニル-2-プロペニル)セファム-3-エン-4-カルボン酸ベンジル
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: C26H25NO6S
Molecular formula furigana: C26-H25-N-O6-S
Molecular weight: 479.550
InChI: InChI=1S/C26H25NO6S/c1-3-21(19-12-8-5-9-13-19)26(31)24(30)27-22(20(15-32-17(2)28)16-34-25(26)27)23(29)33-14-18-10-6-4-7-11-18/h3-13,21,25,31H,1,14-16H2,2H3/t21?,25-,26-/m1/s1
InChI key: BICRXZZDJKDIHG-JNVGEPLTSA-N
SMILES: CC(=O)OCC1=C(N2[C@H](SC1)[C@@](O)(C(C=C)c1ccccc1)C2=O)C(=O)OCc1ccccc1
Systematic name  (3):
  • (7R)-3-(アセトキシメチル)-7-ヒドロキシ-7-(1-フェニル-2-プロペニル)セファム-3-エン-4-カルボン酸ベンジル
  • ベンジル (6R,7R)-3-[(アセチルオキシ)メチル]-7-ヒドロキシ-8-オキソ-7-(1-フェニルプロパ-2-エン-1-イル)-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
  • benzyl (6R,7R)-3-[(acetyloxy)methyl]-7-hydroxy-8-oxo-7-(1-phenylprop-2-en-1-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Other name (1):
  • (7R)-3-(Acetoxymethyl)-7-hydroxy-7-(1-phenyl-2-propenyl)cepham-3-ene-4-carboxylic acid benzyl ester
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