Chem
J-GLOBAL ID：200907097222915990
Nikkaji number：J577.441A
(7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-butenyl]amino]-3-[(carbamoyloxy)methyl]cepham-3-ene-4-carboxylic acid pivaloyloxymethyl ester
(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-[(カルバモイルオキシ)メチル]セファム-3-エン-4-カルボン酸ピバロイルオキシメチル
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： C22H27N5O8S2
Molecular formula furigana： C22-H27-N5-O8-S2
Molecular weight： 553.610
InChI：
InChI=1S/C22H27N5O8S2/c1-5-11(12-8-37-20(23)25-12)15(28)26-13-16(29)27-14(10(6-33-21(24)32)7-36-17(13)27)18(30)34-9-35-19(31)22(2,3)4/h5,8,13,17H,6-7,9H2,1-4H3,(H2,23,25)(H2,24,32)(H,26,28)/b11-5-/t13-,17-/m1/s1
InChI key：
VVYKHPPNFDCVKS-FLDJWWNQSA-N
SMILES：
C/C=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)COC(=O)N)/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-[(カルバモイルオキシ)メチル]セファム-3-エン-4-カルボン酸ピバロイルオキシメチル
- [(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]-3-[(カルバモイルオキシ)メチル]-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-2-カルボニルオキシ]メチル 2,2-ジメチルプロパノアート
- [(6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)but-2-enamido]-3-[(carbamoyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy]methyl 2,2-dimethylpropanoate
- (7R)-7-[[(Z)-2-(2-Amino-4-thiazolyl)-1-oxo-2-butenyl]amino]-3-[(carbamoyloxy)methyl]cepham-3-ene-4-carboxylic acid pivaloyloxymethyl ester
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