Chem
J-GLOBAL ID：200907009837832168
Nikkaji number：J577.444F
(7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-butenyl]amino]-3-[[(1,2,3-thiadiazol-5-yl)thio]methyl]cepham-3-ene-4-carboxylic acid
(7R)-7-[[(Z)-2-(2-アミノ-4-チアゾリル)-1-オキソ-2-ブテニル]アミノ]-3-[[(1,2,3-チアジアゾール-5-イル)チオ]メチル]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： C17H16N6O4S4
Molecular formula furigana： C17-H16-N6-O4-S4
Molecular weight： 496.590
InChI：
InChI=1S/C17H16N6O4S4/c1-2-8(9-6-30-17(18)20-9)13(24)21-11-14(25)23-12(16(26)27)7(5-29-15(11)23)4-28-10-3-19-22-31-10/h2-3,6,11,15H,4-5H2,1H3,(H2,18,20)(H,21,24)(H,26,27)/b8-2-/t11-,15-/m1/s1
InChI key：
QHKHZDJRCSGPPX-FRGJMGNSSA-N
SMILES：
C/C=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)CSc1cnns1)/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-ブテニル]アミノ]-3-[[(1,2,3-チアジアゾール-5-イル)チオ]メチル]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)ブタ-2-エンアミド]-8-オキソ-3-[(1,2,3-チアジアゾール-5-イルスルファニル)メチル]-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)but-2-enamido]-8-oxo-3-[(1,2,3-thiadiazol-5-ylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-butenyl]amino]-3-[[(1,2,3-thiadiazol-5-yl)thio]methyl]cepham-3-ene-4-carboxylic acid
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