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盐酸匹美西林 EP标准品 | 32887-03-9

盐酸匹美西林 EP标准品
Pivmecillinam hydrochloride
32887-03-9
C21H33N3O5S.HCl
476.02976
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:盐酸匹美西林 EP标准品结构式
115162
简介
Pivmecillinam hydrochloride (FL-1039 hydrochloride) 是Mecillinam的口服型前提化合物,广谱抗生素。
名称和标识符
InChIKey UHPXMYLONAGUPC-YKBWBZKYSA-N
Inchi InChI=1S/C21H33N3O5S.ClH/c1-20(2,3)19(27)29-13-28-18(26)15-21(4,5)30-17-14(16(25)24(15)17)22-12-23-10-8-6-7-9-11-23;/h12,14-15,17H,6-11,13H2,1-5H3;1H/b22-12+;/t14-,15+,17-;/m1./s1
SMILES O=C([C@@H](C(C)(C)S[C@]1([H])[C@@H]2/N=C/N3CCCCCC3)N1C2=O)OCOC(C(C)(C)C)=O.[H]Cl
别名信息
- 中文别名 -
  • 2,3',4,4'-四氯联苯
  • 盐酸匹美西林
  • 盐酸匹美西林 EP标准品
  • 匹美西林盐酸盐
- 英文别名 -
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 6-[[(hexahydro-1H-azepin-1-yl)methylene]amino]-3,3-dimethyl-7-oxo-,(2,2-dimethyl-1-oxopropoxy)methyl ester, hydrochloride (1:1), (2S,5R,6R)-
  • 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-(azepan-1-ylmethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate,hydrochloride
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 6-[[(hexahydro-1H-azepin-1-yl)methylene]amino]-3,3-dimethyl-7-oxo-,(2,2-d
  • Amdinocillin pivoxil hydrochloride
  • PIVMECILLINAM
  • Pivmecillinam Hydroc
  • pivmecillinam hydrochloride
  • 2-Pyrrolidinecarboxamide,1-(2,2-dimethyl-1-oxopropyl)-N-methyl
  • Piv-DL-Pro-NHMe
  • Melysin
  • Selexid
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(hexahydro-1H-azepin-1-yl)methylene]amino]-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, monohydrochloride, [2S-(2alpha,5alpha,
  • Pivmecillinam hydrochloride
  • s5473
  • 48FX7N21H2
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(hexahydro-1H-azepin-1-yl)methylene]amino]-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, monohydrochloride, [2S-(2alpha,5alpha,6beta)]-
  • FL-1039
  • DTXCID9025453
  • HY-B0810A
  • PIVMECILLINAM HYDROCHLORIDE [EP MONOGRAPH]
  • Pivmecillinam (hydrochloride)
  • HYDROXYMETHYL (2S,5R,6R)-6-(((HEXAHYDRO-1H-AZEPIN-1-YL)METHYLENE)AMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLATE PIVALATE (ESTER) HYDROCHLORIDE
  • CAS-32887-03-9
  • D01499
  • CHEMBL4303519
  • DTXSID1045453
  • Pivmecillinam HCl
  • Melysin (TN)
  • SR-01000838842-3
  • Q27104782
  • A913043
  • PIVMECILLINAM HYDROCHLORIDE [WHO-DD]
  • BS-17014
  • 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-(azepan-1-ylmethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  • hydrochloride
  • 1H-AZEPIN-1-YL)METHYLENE)AMINO)-3,3-DIMETHYL-7-OXO-, HYDROXYMETHYL ESTER PIVALATE (ESTER), MONOHYDROCHLORIDE, (+)-
  • J-018915
  • AKOS030526136
  • 32887-03-9
  • CCG-221053
  • pivmecilinamo clorhidrato
  • SR-01000838842
  • Tox21_110625
  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((hexahydro-1H-azepin-1-yl)methylene)amino)-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, monohydrochloride, (2S-(2alpha,5alpha,6beta))-
  • BCP07839
  • MLS002154128
  • amdinocillin pivoxil hydrochloride
  • SMR001233435
  • CHEBI:51213
  • (pivaloyloxy)methyl (2S,5R,6R)-6-(((E)-azepan-1-ylmethylene)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride
  • CHEMBL1355196
  • C74675
  • Pivmecilinamo clorhidrato [Spanish]
  • (Pivaloyloxy)methyl (2S,5R,6R)-6-((azepan-1-ylmethylene)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride
  • PIVMECILLINAM HYDROCHLORIDE [MART.]
  • HMS1571C08
  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((hexahydro-1H-azepin-1-yl)methylene)amino)-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, monohydrochloride, (2S,5R,6R)-
  • NCGC00016813-01
  • Pivmecillinam hydrochloride [JAN]
  • AMDINOCILLIN PIVOXIL HYDROCHLORIDE [MI]
  • pivmecillinamhydrochloride
  • SCHEMBL232687
  • Pivmecillinam hydrochloride (JP17)
  • EINECS 251-278-7
  • Methylene 2,2-dimethylpropanoate (2S,5R,6R)-6-[[(hexahydro-1H-azepin-1-yl)methylene]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride
  • UNII-48FX7N21H2
  • FL-1039 hydrochloride
物化性质
实验特性
LogP 3.08940
PSA 113.81000
沸点 581°C at 760 mmHg
熔点 172-173°
比旋光度 D20 +219° (c = 1 in 0.1N HCl)
计算特性
精确分子量 475.19100
氢键供体数量 0
氢键受体数量 8
可旋转化学键数量 8
同位素质量 475.1907701g/mol
重原子数量 31
复杂度 710
同位素原子数量 0
确定原子立构中心数量 3
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 2
拓扑分子极性表面积 114Ų
国际标准相关数据
EINECS 251-278-7
专业数据库参考
PubChemId 115162
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