Chemical Compound

(4R,5S,6S)-3-(((3S,5R)-5-((3-((2R,4S)-4-(((4R,5S,6S)-2-carboxy-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-en-3-yl)thio)-2-((3-carboxyphenyl)carbamoyl)pyrrolidine-1-carbonyl)phenyl)carbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

CAS Registry Number 1401451-19-1
(4R,5S,6S)-3-(((3S,5R)-5-((3-((2R,4S)-4-(((4R,5S,6S)-2-carboxy-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-en-3-yl)thio)-2-((3-carboxyphenyl)carbamoyl)pyrrolidine-1-carbonyl)phenyl)carbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 结构式
Primary record

(4R,5S,6S)-3-(((3S,5R)-5-((3-((2R,4S)-4-(((4R,5S,6S)-2-carboxy-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-en-3-yl)thio)-2-((3-carboxyphenyl)carbamoyl)pyrrolidine-1-carbonyl)phenyl)carbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

库存
2,587 克
纯度
98.4 %
CAS
1401451-19-1

化合物标识与属性

CAS
1401451-19-1
PubChem CID
175674340
SMILES
C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@@H](NC3)C(=O)NC4=CC=CC(=C4)C(=O)N5C[C@H](C[C@@H]5C(=O)NC6=CC=CC(=C6)C(=O)O)SC7=C(N8[C@H]([C@H]7C)[C@H](C8=O)[C@@H](C)O)C(=O)O)C(=O)O)[C@@H](C)O
Canonical SMILES
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@@H](C(=O)Nc4cccc(C(=O)N5C[C@@H](SC6=C(C(=O)O)N7C(=O)[C@H]([C@@H](C)O)[C@H]7[C@H]6C)C[C@@H]5C(=O)Nc5cccc(C(=O)O)c5)c4)C3)[C@H](C)[C@H]12

名称与同义词

  • Ertapenem Impurity 20
  • Ertapenem Impurity 35
  • (4R,5S,6S)-3-(((3S,5R)-5-((3-((2R,4S)-4-(((4R,5S,6S)-2-carboxy-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-en-3-yl)thio)-2-((3-carboxyphenyl)carbamoyl)pyrrolidine-1-carbonyl)phenyl)carbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
  • 1401451-19-1