Chem
J-GLOBAL ID：200907020375233844
Nikkaji number：J577.446B
(7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-pentenyl]amino]-3-chlorocepham-3-ene-4-carboxylic acid
(7R)-7-[[(Z)-2-(2-アミノ-4-チアゾリル)-1-オキソ-2-ペンテニル]アミノ]-3-クロロセファム-3-エン-4-カルボン酸
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
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
Molecular formula： C15H15ClN4O4S2
Molecular formula furigana： C15-H15-CL-N4-O4-S2
Molecular weight： 414.880
InChI：
InChI=1S/C15H15ClN4O4S2/c1-2-3-6(8-5-26-15(17)18-8)11(21)19-9-12(22)20-10(14(23)24)7(16)4-25-13(9)20/h3,5,9,13H,2,4H2,1H3,(H2,17,18)(H,19,21)(H,23,24)/b6-3-/t9-,13-/m1/s1
InChI key：
OAEXEAJSDRQHBN-AJYXQNANSA-N
SMILES：
CC/C=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)Cl)/c1csc(N)n1
Systematic name (3)：
- (7R)-7-[[(Z)-2-(2-アミノ-4-チアゾリル)-1-オキソ-2-ペンテニル]アミノ]-3-クロロセファム-3-エン-4-カルボン酸
- (6R,7R)-7-[(2Z)-2-(2-アミノ-1,3-チアゾール-4-イル)ペンタ-2-エンアミド]-3-クロロ-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
- (6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enamido]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-pentenyl]amino]-3-chlorocepham-3-ene-4-carboxylic acid
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