Chem
J-GLOBAL ID:200907024975266210   Nikkaji number:J294.805B

(6R,7R)-3-[(Acetyloxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid sodium salt

(6R,7R)-3-[(アセチルオキシ)メチル]-7-アミノ-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: C10H11N2NaO5S
Molecular formula furigana: C10-H11-N2-NA-O5-S
Molecular weight: 294.260
InChI: InChI=1S/C10H12N2O5S.Na/c1-4(13)17-2-5-3-18-9-6(11)8(14)12(9)7(5)10(15)16;/h6,9H,2-3,11H2,1H3,(H,15,16);/q;+1/p-1/t6-,9-;/m1./s1
InChI key: PVCIUMOLXPZFHR-SOWVLMPRSA-M
SMILES: CC(=O)OCC1=C(N2[C@H](SC1)[C@H](N)C2=O)C(=O)O[Na]
Systematic name  (3):
  • (6R,7R)-3-[(アセチルオキシ)メチル]-7-アミノ-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-2-カルボン酸ナトリウム
  • ナトリウム (6R,7R)-3-[(アセチルオキシ)メチル]-7-アミノ-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)-3-[(acetyloxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Other name (1):
  • (6R,7R)-3-[(Acetyloxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid sodium salt
CAS registry number: 40994-22-7
Regulation number (1):
  • EINECS2551695
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