Chem
J-GLOBAL ID:202207008746181004   Nikkaji number:J3.769.197F

Ceftolozane

セフトロザン
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: C23H30N12O8S2
Molecular formula furigana: C23-H30-N12-O8-S2
Molecular weight: 666.690
InChI: InChI=1S/C23H30N12O8S2/c1-23(2,20(40)41)43-31-11(15-30-21(26)45-32-15)16(36)29-12-17(37)35-13(19(38)39)9(8-44-18(12)35)6-34-7-10(14(25)33(34)3)28-22(42)27-5-4-24/h7,12,18,25H,4-6,8,24H2,1-3H3,(H7,26,27,28,29,30,32,36,38,39,40,41,42)/b31-11-/t12-,18-/m1/s1
InChI key: JHFNIHVVXRKLEF-DCZLAGFPSA-N
SMILES: N12C(=C(CS[C@@H]1[C@@H](C2=O)NC(=O)/C(=N\OC(C)(C(=O)O)C)/c1nsc(n1)N)C[n+]1n(c(c(c1)NC(=O)NCCN)N)C)C(=O)[O-]
Systematic name  (3):
  • (6R,7R)-3-[[4-[[(2-アミノエチル)アミノ]カルボニルアミノ]2-メチル-3-アミノ-2H-ピラゾール-1-イウム]-1-イルメチル]-7-[(2Z)-2-(5-アミノ-1,2,4-チアジアゾール-3-イル)-2-[(1-メチル-1-カルボキシエチルオキシ)イミノ]アセチルアミノ]-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
  • 5-アミノ-2-{[(6R,7R)-7-[(2Z)-2-(5-アミノ-1,2,4-チアジアゾール-3-イル)-2-[(1-カルボキシ-1-メチルエトキシ)イミノ]アセトアミド]-2-カルボキシラト-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-3-イル]メチル}-4-{[(2-アミノエチル)カルバモイル]アミノ}-1-メチル-1H-ピラゾール-2-イウム
  • 5-amino-2-{[(6R,7R)-7-[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-[(1-carboxy-1-methylethoxy)imino]acetamido]-2-carboxylato-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}-4-{[(2-aminoethyl)carbamoyl]amino}-1-methyl-1H-pyrazol-2-ium
Other name (2):
  • セフトロザン
  • Ceftolozane
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