Chem
J-GLOBAL ID:200907000965278400
Nikkaji number:J392.466A
(5R)-3-[(Quinolin-8-yl)thio]-6β-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 2-sodium salt
(5R)-3-[(キノリン-8-イル)チオ]-6β-エチル-7-オキソ-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボン酸2-ナトリウム
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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:
C18 H15 N2 NaO3 S
Molecular formula furigana:
C18-H15-N2-NA-O3-S
Molecular weight:
362.380
InChI:
InChI=1S/C18H16N2O3S.Na/c1-2-11-12-9-14(16(18(22)23)20(12)17(11)21)24-13-7-3-5-10-6-4-8-19-15(10)13;/h3-8,11-12H,2,9H2,1H3,(H,22,23);/q;+1/p-1/t11-,12-;/m1./s1
InChI key:
UMMXKCKWYDHWMK-MNMPKAIFSA-M
SMILES:
CC[C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O[Na])Sc1cccc2cccnc12
Systematic name (3):
(5R)-3-[(キノリン-8-イル)チオ]-6β-エチル-7-オキソ-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボン酸2-ナトリウム
ナトリウム (5R,6R)-6-エチル-7-オキソ-3-(キノリン-8-イルスルファニル)-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
sodium (5R,6R)-6-ethyl-7-oxo-3-(quinolin-8-ylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
Other name (1):
(5R)-3-[(Quinolin-8-yl)thio]-6β-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 2-sodium salt
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