Account Meropenem p-nitrobenzyl diester
- Catalog No. :
- ACXPQV065
- CAS No. :
- 96036-02-1
- Molecular Formula :
- C32H35N5O11S
- Molecular Weight :
- 697.72
IUPAC Name:4-nitrobenzyl (4R,5S,6S)-3-(((3S,5S)-5-(dimethylcarbamoyl)-1-(((4-nitrobenzyl)oxy)carbonyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
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Product Information
| Product Name | Meropenem p-nitrobenzyl diester |
|---|---|
| IUPAC Name | 4-nitrobenzyl (4R,5S,6S)-3-(((3S,5S)-5-(dimethylcarbamoyl)-1-(((4-nitrobenzyl)oxy)carbonyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate |
| MDL No. | MFCD08703333 |
| Molecular Formula | C32H35N5O11S |
| Molecular Weight | 697.72 |
| SMILES | O=C(C(N12)=C(S[C@@H]3CN(C(OCC4=CC=C([N+]([O-])=O)C=C4)=O)[C@H](C(N(C)C)=O)C3)[C@H](C)[C@]2([H])[C@@H]([C@H](O)C)C1=O)OCC5=CC=C([N+]([O-])=O)C=C5 |
| InChI Key | PJGGEFUAFDAJJT-ALUDVLAQSA-N |
| Synonym | p-nitrobenzyl (4R,5S,6S)-3-<(3S,5S)-5-dimethylaminocarbonyl-1-(p-nitrobenzyloxycarbonyl)pyrrolidin-3-ylthio>-6-<(1R)-1-hydroxyethyl>-4-methyl-7-oxo-1-azabicyclo<3.2.0>hept-2-en-2-carboxylate;3-[[5-[(Dimethylamino)Carbonypyrrolidinyl]Thio]-6-(1-Hydroxyethyl)-4-Methyl-7-Oxo-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid, (4-Nitrophenyl)Methyl Ester;3-[[5-[(Dimethylamino)Carbonyl-Pyrrolidinyl]Thio]-6-(1-Hydroxyethyl)-4-Methyl-7-Oxo-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid, (4-Nitrophenyl)Methyl Ester;(4R,5S,6S)-4-NITROBENZYL-3-[[(3S,5S)-5-[(DIMETHYLAMINO)CARBONYL]-1-[[(4-NITROBENZYL)OXY] CARBONYL]-3-PYRROLIDINYL]THIO]-6-[(1R)-1-HYDROXYETHYL]-4-METHYL-7-OXO-1-AZABICYCLO[3,2,0] HEPT-2-ENE-2-CARBOXYLATE;4-nitrobenzyl (5s,6s)-3-[((3s,5s)-5-[(dimethylamino)carbonyl]-1-{[(4-nitrobenzyl)oxy]carbonyl}pyrrolidinyl)sulfanyl]-6-[(1r)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate;3-[[5-[(DIMETHYLAMINO)CARBONY PYRROLIDINYL] THIO]-6-(1-HYDROXYETHYL)-4-METHYL-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID, (4-NITROPHENYL)METHYL ESTER;MeropeneM InterMediates(E-8,MRPM-PNB);p-Nitrobenzyl(1R,5S,6S)-2-[(3S,5S)-(5-dimethylaminocarbonyl-1-p-nitrobenzyloxycarbonyl)pyrrolidin-3-carboxylate |
| CAS No. | 96036-02-1 |
| PubChem CID | 10974502 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACXPQV065 Molecular Building Block Synthetic Route
Doripenem Condensation Compound
(4R,5S,6S)-3-(((3S,5S)-1-((2S,3R)-2-((2S,3R)-5-Carboxy-4-(((3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl)thio)-3-methyl-2,3-dihydro-1H-pyrrol-2-yl)-3-hydroxybutanoyl)-5-(dimethylcarbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
(4R,5S,6S)-3-(((3S,5S)-5-(Dimethylcarbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid trihydrate