Chem
J-GLOBAL ID:200907046802045450   Nikkaji number:J442.482D

(5R)-6β-[(R)-1-Hydroxyethyl]-3-[4-(methylcarbamoyl)phenyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid potassium salt

(5R)-6β-[(R)-1-ヒドロキシエチル]-3-[4-(メチルカルバモイル)フェニル]-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボン酸カリウム
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: C16H15KN2O5S
Molecular formula furigana: C16-H15-K-N2-O5-S
Molecular weight: 386.460
InChI: InChI=1S/C16H16N2O5S.K/c1-7(19)10-14(21)18-11(16(22)23)12(24-15(10)18)8-3-5-9(6-4-8)13(20)17-2;/h3-7,10,15,19H,1-2H3,(H,17,20)(H,22,23);/q;+1/p-1/t7-,10+,15-;/m1./s1
InChI key: CRZJZWRCGZPXRD-AWEBKZFASA-M
SMILES: CNC(=O)c1ccc(cc1)C1=C(N2[C@H](S1)[C@@H]([C@@H](C)O)C2=O)C(=O)O[K]
Systematic name  (3):
  • (5R)-6β-[(R)-1-ヒドロキシエチル]-3-[4-(メチルカルバモイル)フェニル]-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボン酸カリウム
  • カリウム (5R,6S)-6-[(1R)-1-ヒドロキシエチル]-3-[4-(メチルカルバモイル)フェニル]-7-オキソ-4-チア-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボキシラート
  • potassium (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-[4-(methylcarbamoyl)phenyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
Other name (1):
  • (5R)-6β-[(R)-1-Hydroxyethyl]-3-[4-(methylcarbamoyl)phenyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid potassium salt
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