Chem
J-GLOBAL ID:200907062526795879
Nikkaji number:J596.929H
Cefluprenam
セフルプレナム
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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:
C20 H25 FN7 [N+]O5 [O-]S2
Molecular formula furigana:
C20-H25-F-N8-O6-S2
Molecular weight:
556.590
InChI:
InChI=1S/C20H25FN8O6S2/c1-3-29(2,7-11(22)30)6-4-5-10-8-36-18-13(17(32)28(18)14(10)19(33)34)24-16(31)12(26-35-9-21)15-25-20(23)37-27-15/h4-5,13,18H,3,6-9H2,1-2H3,(H5-,22,23,24,25,27,30,31,33,34)/b5-4+,26-12-/t13-,18-,29?/m1/s1
InChI key:
XAKKNLNAJBNLPC-MAYKBZFQSA-N
SMILES:
CC[N+](C)(C/C=C/C1=C(N2[C@H](SC1)[C@H](NC(=O)/C(=N\OCF)/c1nsc(N)n1)C2=O)C(=O)[O-])CC(=O)N
Systematic name (3):
[E,(-)]-3-[7β-[[(Z)-1-オキソ-2-[(フルオロメトキシ)イミノ]-2-(5-アミノ-1,2,4-チアジアゾール-3-イル)エチル]アミノ]-4-(カルボキシラト)セファム-3-エン-3-イル]-N-メチル-N-エチル-N-(カルバモイルメチル)-2-プロペン-1-アミニウム
(6R,7R)-7-[(2Z)-2-(5-アミノ-1,2,4-チアジアゾール-3-イル)-2-[(フルオロメトキシ)イミノ]アセトアミド]-3-[(1E)-3-[(カルバモイルメチル)(エチル)メチルアザニウミル]プロパ-1-エン-1-イル]-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-2-カルボキシラート
(6R,7R)-7-[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-[(fluoromethoxy)imino]acetamido]-3-[(1E)-3-[(carbamoylmethyl)(ethyl)methylazaniumyl]prop-1-en-1-yl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Other name (7):
セフルプレナム
Cefluprenam
[E,(-)]-3-[7β-[[(Z)-1-Oxo-2-[(fluoromethoxy)imino]-2-(5-amino-1,2,4-thiadiazole-3-yl)ethyl]amino]-4-(carboxylato)cepham-3-ene-3-yl]-N-methyl-N-ethyl-N-(carbamoylmethyl)-2-propene-1-aminium
E-1077
セフプレナム
Cefprenam
(7R)-7-[2-(5-アミノ-1,2,4-チアジアゾール-3-イル)-2-[(Z)-(フルオロメトキシ)イミノ]アセチルアミノ]-3-[(E)-3-[N-(アミノカルボニルメチル)-N-エチル-N-メチルアミニオ]-1-プロペニル]セファム-3-エン-4-カルボキシラート
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CAS registry number:
116853-25-9
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