CAS 90776-59-3

(4-Nitrofenil)metil (4R,5R,6S)-3-[(difenoxifosfinil)oxi]-6-[(1R)-1-hidroxietil]-4-metil-7-oxo-1-azabiciclo[3.2.0]hept-2-eno-2-carboxilato

Descrição:

A substância química conhecida como "(4-Nitrofenil)metil (4R,5R,6S)-3-[(difenoxifosfinil)oxi]-6-[(1R)-1-hidroxietil]-4-metil-7-oxo-1-azabiciclo[3.2.0]hept-2-eno-2-carboxilato" com o número CAS 90776-59-3 é um composto orgânico complexo caracterizado por sua estrutura bicíclica, que inclui um átomo de nitrogênio no sistema de anéis. Este composto apresenta múltiplos grupos funcionais, incluindo um moiety nitrofenila, um grupo difenoxifosfinila e um carboxilato, que contribuem para sua potencial atividade biológica. A estereoquímica indicada pelas designações (4R,5R,6S) e (1R) sugere arranjos espaciais específicos de átomos, que podem influenciar significativamente a reatividade do composto e sua interação com alvos biológicos. Sua complexidade estrutural pode conferir propriedades únicas, tornando-o de interesse na química medicinal ou como um potencial agente farmacêutico. A presença do grupo fosfinila sugere aplicações potenciais em áreas como inibição enzimática ou como um pró-fármaco. No geral, este composto exemplifica o design intrincado frequentemente encontrado em moléculas bioativas.

Fórmula: C₂₉H₂₇N₂O₁₀P

InChI: InChI=1S/C29H27N2O10P/c1-18-25-24(19(2)32)28(33)30(25)26(29(34)38-17-20-13-15-21(16-14-20)31(35)36)27(18)41-42(37,39-22-9-5-3-6-10-22)40-23-11-7-4-8-12-23/h3-16,18-19,24-25,32H,17H2,1-2H3/t18-,19-,24-,25-/m1/s1

Chave InChI: InChIKey=STULDTCHQXVRIX-PIYXRGFCSA-N

SMILES: C(OCC1=CC=C(N(=O)=O)C=C1)(=O)C=2N3[C@@]([C@@]([C@@H](C)O)(C3=O)[H])([C@@H](C)C2OP(OC4=CC=CC=C4)(OC5=CC=CC=C5)=O)[H]

Sinónimos:

• (1R,5R,6S)-6-[(1R)-1-Hydroxyethyl]-2-[(diphenylphosphono)-oxy]-1-methylcarbapen-2-em-3-carboxylic acid 4-nitrobenzyl ester
• (1R,5S,6S)-2-(diphenyloxy)phosphoryloxy-6-[(1R)-1-hydroxyethyl]-1-methyl-1-carbapen-2-em-3-carboxylate
• (4-Nitrophenyl)methyl (4R,5R,6S)-3-[(diphenoxyphosphinyl)oxy]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
• (4R,5S,6S)-3-(diphenyl-oxy)phosphoryloxy-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3,2,0]hept-2-ene-2-carboxylate
• 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[(diphenoxyphosphinyl)oxy]-6-(1-hydroxyethyl)-4-methyl-7-oxo-, (4-nitrophenyl)methyl ester, [4R-[4α,5β,6β(R*)]]-
• 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[(diphenoxyphosphinyl)oxy]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-, (4-nitrophenyl)methyl ester, (4R,5R,6S)-
• 4-Nitrobenzyl (4R,5R,6S)-3-[(diphenylphosphono)oxy]-6-[(R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
• 4-nitrobenzyl (4R,5R,6S)-3-[(diphenoxyphosphoryl)oxy]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
• Beta-Methyl vinyl phosphate
• Map/Mvp
• P-Nitrobenzyl (1R,5R,6S)-6-[(1R)-1-hydroxyethyl]-2-
• [4R-[4α, 5β,6β(R*)]]-3-[(diphenoxyphosphinyl)oxy]-6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
• beta-Methyl vinyl phosphate MAP
• p-Nitrobenzyl (4R,5R,6S)-3-diphenylphosphoryloxy-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
• p-Nitrobenzyl (4R,5S,6S)-3-(diphenoxy)phosphoryloxy-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.1]hept-2-ene-2-carboxylate

(4R,5R,6S)-4-Nitrobenzyl 3-((diphenoxyphosphoryl)oxy)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

CAS: 90776-59-3

Fórmula: C₂₉H₂₇N₂O₁₀P

Pureza: 96%

Cor e Forma: Solid

Peso molecular: 594.5058

Ref: IN-DA00ILR0

β-Methyl Vinyl Phosphate

CAS: 90776-59-3

β-Methyl Vinyl Phosphate

Pureza: 98%

Peso molecular: 594.51g/mol

Ref: 54-OR1012388

(4-Nitrophenyl)methyl (4R,5R,6S)-3-Diphenoxyphosphoryloxy-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

CAS: 90776-59-3

Cor e Forma: Neat

Ref: 86-MM1327.03

Doripenem Impurity 12

CAS: 90776-59-3

Fórmula: C₂₉H₂₇N₂O₁₀P

Peso molecular: 594.51

Ref: 4Z-D-5722

4-Nitrobenzyl (4R,5R,6S)-3-[(diphenylphosphono)oxy]-6-[(R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylat e

CAS: 90776-59-3

4-Nitrobenzyl (4R,5R,6S)-3-[(diphenylphosphono)oxy]-6-[(R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylat e is a synthetic compound that is used as an alkalizer and impurity scavenger in the manufacture of pesticides and other organic chemicals. It has been shown to be a stereoselective herbicide with acetonitrile as its primary degradation product. The compound has also been found to be a potent inhibitor of the enzyme carbapenemase, which may lead to increased resistance to antibiotics such as monosodium salt of ertapenem.

Fórmula: C₂₉H₂₇N₂O₁₀P

Pureza: Min. 98 Area-%

Cor e Forma: White Powder

Peso molecular: 594.51 g/mol

Ref: 3D-FM140061

4-Nitrobenzyl (4R,5S,6S)-3-[(Diphenylphosphono)oxy]-6-[(R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Produto Controlado

CAS: 90776-59-3

Fórmula: C₂₉H₂₇N₂O₁₀P

Cor e Forma: Neat

Peso molecular: 594.51

Ref: TR-N493650