Account Doripenem Condensation Compound
- Catalog No. :
- ACDUGC877
- CAS No. :
- 491878-07-0
- Molecular Formula :
- C30H34N6O12S2
- Molecular Weight :
- 734.77
IUPAC Name:4-nitrobenzyl (5S,6S)-6-((R)-1-hydroxyethyl)-4-methyl-3-(((3S,5S)-1-(((4-nitrobenzyl)oxy)carbonyl)-5-((sulfamoylamino)methyl)pyrrolidin-3-yl)thio)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
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Product Information
| Product Name | Doripenem Condensation Compound |
|---|---|
| IUPAC Name | 4-nitrobenzyl (5S,6S)-6-((R)-1-hydroxyethyl)-4-methyl-3-(((3S,5S)-1-(((4-nitrobenzyl)oxy)carbonyl)-5-((sulfamoylamino)methyl)pyrrolidin-3-yl)thio)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate |
| Molecular Formula | C30H34N6O12S2 |
| Molecular Weight | 734.77 |
| SMILES | CC1C(S[C@H]2C[C@@H](CNS(N)(=O)=O)N(C(=O)OCC3=CC=C([N+](=O)[O-])C=C3)C2)=C(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)N2C(=O)[C@H]([C@@H](C)O)[C@@H]12 |
| InChI Key | NFGMWAKGHQALBE-IFZPCJAWSA-N |
| Synonym | (4R,5S,6S)-3-[[(3S,5S)-5-[[(Aminosulfonyl)amino]methyl]-1-[[(4-nitrophenyl)methoxy]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (4-nitrophenyl)methyl ester;Doripenem Condensation Compound;Doripenem condensate;4-nitrobenzyl (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-4-methyl-3-[[(3S,5S)-1-(4-nitrobenzyloxycarbonyl)-5-(sulfamoylaminomethyl)pyrrolidin-3-yl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate;(4R,5S,6S)-3-[[(3S,5S)-5-[[(Aminosulfonyl)amino]methyl]-1-[[(4-nitrophenyl)methoxy]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-o;Doripenem Impurity;1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[[(3S,5S)-5-[[(aminosulfonyl)amino]methyl]-1-[[(4-nitrophenyl)methoxy]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-, (4-nitrophenyl)methyl ester, (4R,5S,6S)-;(4R,5S,6S)-3-[[(3S,5S)-5-[[(Aminosulfonyl)amino]methyl]-1-[[(4-nitrophenyl)methoxy]carbonyl]-3-pyrrolidinyl]thioChemicalbook]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylicacid(4-nitrophenyl)methylester USP/EP/BP |
| CAS No. | 491878-07-0 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACDUGC877 Molecular Building Block Synthetic Route
Meropenem p-nitrobenzyl diester
(4R,5S,6S)-6-((R)-1-Hydroxyethyl)-4-methyl-7-oxo-3-(((3S,5S)-5-((sulfamoylamino)methyl)pyrrolidin-3-yl)thio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid hydrate
(4R,5S,6S)-6-((R)-1-Hydroxyethyl)-4-methyl-7-oxo-3-(((3S,5S)-5-((sulfamoylamino)methyl)pyrrolidin-3-yl)thio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid