Chem
J-GLOBAL ID：200907069262540065
Nikkaji number：J577.447K
(7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-pentenyl]amino]-3-ethenylcepham-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-エテニルセファム-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： C17H18N4O4S2
Molecular formula furigana： C17-H18-N4-O4-S2
Molecular weight： 406.480
InChI：
InChI=1S/C17H18N4O4S2/c1-3-5-9(10-7-27-17(18)19-10)13(22)20-11-14(23)21-12(16(24)25)8(4-2)6-26-15(11)21/h4-5,7,11,15H,2-3,6H2,1H3,(H2,18,19)(H,20,22)(H,24,25)/b9-5-/t11-,15-/m1/s1
InChI key：
ACWPWQMNVNCBSC-QCUYBLOWSA-N
SMILES：
CC/C=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)C=C)/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-エテニルセファム-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)ペンタ-2-エンアミド]-3-エテニル-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-ethenyl-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-ethenylcepham-3-ene-4-carboxylic acid
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