Category: 1953146-81-0

Today I’d like to introduce a new chemical compound, CAS is 1953146-81-0, Name is 36-(((2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-21,21-bis((3-((3-(5-(((2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)pentanamido)propyl)amino)-3-oxopropoxy)methyl)-19,26,32-trioxo-4,7,10,13,16,23-hexaoxa-20,27,31-triazahexatriacontan-1-oic acid, Formula is C75H134N10O35, Molecular Weight is 1735.91g/mol. Because of its complex structure and huge molecular weight, this compound is rarely understood. Now let me introduce some knowledge about its synthesis.. Safety of 1953146-81-0

The general reactant of this compound is 1-(Phenylmethyl) dodecanedioate;4,8-Dioxa-12,16-diazaheneicosanamide, 6-amino-11,17-dioxo-6-[[3-oxo-3-[[3-[[1-oxo-5-[[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]pentyl]amino]propyl]amino]propoxy]methyl]-N-[3-[[1-oxo-5-[[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]pentyl]amino]propyl]-21-[[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]-, 2,2,2-trifluoroacetate (1:1), Reagents is Diisopropylethylamine, 1-[Bis(dimethylamino)methylene]-1H-benzotriazolium hexafluorophosphate(1-) 3-oxide, Catalyst(), Solvent is Dimethylformamide, Products 1646203-74-8, Yield: 74%, Synthetic Methods procedure :1. Add HBTU ( 3.28 g, 8.64 mmol ) and DIEA ( 4.10 mL, 23.58 mmol ) to a solution of dodecanoic acid monobenzyl ester ( 2.51 g, 7.86 mmol ) in DMF ( 80 mL ) and stir the resulting mixture for few minutes., 2. Add a solution of reactant ( 15 g, 5.24 mmol ) in DMF ( 20 mL ) and continue stirring at room temperature overnight., 3. Remove the solvents and volatiles under reduced pressure., 4. Dissolve the residue in DCM ( 200 mL ) , wash with saturated NaHCO3 ( 100 mL ) and water ( 100 mL ) ., 5. Dry over anhydrous Na2SO4, evaporate the solvent under reduced pressure., 6. Purify the residue by silica gel chromatography ( eluent: 3-15% MeOH in DCM ) ., Transfornation (Acylation of Nitrogen Nucleophiles by Carboxylic Acids. Characterization Data include ‘s Proton NMR Spectrum : ( 400 MHz, DMSO-d 6 ) : δ 7.86–7.77 ( m, 6H, NH ) ; 7.72 ( t, J = 5.7 Hz, 3H, NH ) ; 7.39-7.28 ( m, 5H ) ; 6.97 ( s, 1H, NH ) ; 5.20 ( d, J = 3.4 Hz, 3H, sugar H4 ) ; 5.07 ( s, 2H ) ; 4.95 ( dd, J = 3.4, 11.2 Hz, 3H, sugar H3 ) ; 4.47 ( d, J = 8.5 Hz, 3H, sugar H1 ) ; 4.07–3.96 ( m, 9H, sugar H5, H6, H6′ ) ; 3.86 ( dt, J = 8.9, 11.2 Hz, 3H, sugar H 2 ) ; 3.69 ( dt, J = 5.9, 9.9 Hz, 3H ) ; 3.60-3.45 ( m, 12H ) ; 3.39 ( dt, J = 6.3, 9.9 Hz, 3H ) ; 3.08-2.95 ( m, 12H ) ; 2.32 ( t, J = 7.4 Hz, 2H ) ; 2.26 ( t, J = 6.3 Hz, 6H ) ; 2.09 ( s, 9H ) , 2.03 ( t, J = 7.0 Hz, 8H ) ; 1.98 ( s, 9H ) ; 1.88 ( s, 9H ) , 1.76 ( s, 9H ) ; 1.56–1.36 ( m, 22H ) ; 1.28–1.14 ( m, 12H ) ., Carbon-13 NMR : ( 126 MHz, DMSO-d 6 ) : δ 172.8, 172.5, 171.9, 170.1, 170.0, 169.9, 169.6, 169.4, 136.3, 128.4, 128.0, 127.9, 101.0, 70.5, 69.8, 68.7, 68.3, 67.3, 66.7, 65.3, 61.4, 59.5, 49.4, 36.4, 36.3, 36.0, 35.9, 35.1, 33.5, 29.5, 28.9, 28.9, 28.8, 28.7, 28.6, 28.6, 28.4, 25.3, 24.5, 22.8, 21.9, 20.5, 20.5, 20.4., Mass Spectrum: MS calc. for C98H154N10O39: 2095.03; found: 2118.05 ( M+Na+, MALDI-TOF, matrix: HABA ) ., State is offwhite solid

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Reference:
CAS Reaction Number: 31-355-CAS-9994399,
,CAS Method Number: 3-614-CAS-3165786

Today I’d like to introduce a new chemical compound, CAS is 1953146-81-0, Name is 36-(((2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-21,21-bis((3-((3-(5-(((2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)pentanamido)propyl)amino)-3-oxopropoxy)methyl)-19,26,32-trioxo-4,7,10,13,16,23-hexaoxa-20,27,31-triazahexatriacontan-1-oic acid, Formula is C75H134N10O35, Molecular Weight is 1735.91g/mol. Because of its complex structure and huge molecular weight, this compound is rarely understood. Now let me introduce some knowledge about its synthesis.. Safety of 1953146-81-0

The general reactant of this compound is 1-[(3R,5S)-5-[[Bis(4-methoxyphenyl)phenylmethoxy]methyl]-1-[1,12,19,25-tetraoxo-14,14-bis[[3-oxo-3-[[3-[[1-oxo-5-[[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]pentyl]amino]propyl]amino]propoxy]methyl]-29-[[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]-16-oxa-13,20,24-triazanonacos-1-yl]-3-pyrrolidinyl] butanedioate;Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl-, 3′-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite]；Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-, 3′-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite]；Cytidine, N-acetyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl-, 3′-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite]；Guanosine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-N-(2-methyl-1-oxopropyl)-, 3′-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite], Reagents is Methylamine, Triethylamine trihydrofluoride, Catalyst(), Solvent is Pyridine；Water, Products RNA, ((2′-deoxy-2′-fluoro)A-Am-(2′-deoxy-2′-fluoro)C-Am-(2′-deoxy-2′-fluoro)G-Um-(2′-deoxy-2′-fluoro)G-Um-(2′-deoxy-2′-fluoro)U-Cm-(2′-deoxy-2′-fluoro)U-Um-(2′-deoxy-2′-fluoro)G-Cm-(2′-deoxy-2′-fluoro)U-Cm-(2′-deoxy-2′-fluoro)U-Am-(2′-deoxy-2′-fluoro)U-Am-A), 3′-[[(2S,4R)-1-[29-[[2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]-14,14-bis[[3-[[3-[[5-[[2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]oxy]-1-oxopentyl]amino]propyl]amino]-3-oxopropoxy]methyl]-1,12,19,25-tetraoxo-16-oxa-13,20,24-triazanonacos-1-yl]-4-hydroxy-2-pyrrolidinyl]methyl hydrogen phosphate], complex with RNA (Um-(2′-deoxy-2′-fluoro)U-Am-(2′-deoxy-2′-fluoro)U-Am-(2′-deoxy-2′-fluoro)G-Am-(2′-deoxy-2′-fluoro)G-Cm-(2′-deoxy-2′-fluoro)A-Am-(2′-deoxy-2′-fluoro)G-Am-(2′-deoxy-2′-fluoro)A-Cm-(2′-deoxy-2′-fluoro)A-Cm-(2′-deoxy-2′-fluoro)U-Gm-(2′-deoxy-2′-fluoro)U-Um-sp-(2′-deoxy-2′-fluoro)U-sp-Um) (1:1), Synthetic Methods procedure :1. Synthesize sense and antisense strands on an ABI synthesizer using commercially available 5′-O- ( 4, 4′-dimethoxytrityl ) -2′-deoxy-2′-fluoro-, 5′-O- ( 4, 4′-dimethoxytrityl ) -2′-O- ( tert-butyldimethylsilyl ) -, and 5′-O- ( 4, 4′-dimethoxytrityl ) -2′-O-methyl- 3′-O- ( 2-cyanoethyl-N, N-diisopropyl ) phosphoramidite monomers of uridine, 4-N-acetylcytidine, 6-N-benzoyladenosine, and 2-N-isobutyrylguanosine using standard solid-phase oligonucleotide synthesis and deprotection protocols., 2. Add phosphorothioate linkages by oxidation of phosphite utilizing 0.1 M DDTT in pyridine., 3. Treat the support with 40% aqueous methylamine at 45 °C for 1.5 hour., 4. Filter the suspension through a 0.2-μm filter to remove solid residues., 5. Vortex the combined filtrate with Et3N·3HF at 40 °C for 1 hour to remove tert-butyldimethylsilyl ( TBDMS ) protecting groups from the oligonucleotide., 6. Purify the ligand-conjugated and unconjugated oligonucleotides by anion-exchange high-performance liquid chromatography ( IEX-HPLC ) with TSK-Gel Super Q-5PW support using a linear gradient of 22-42% buffer B over 130 min with 50 ml/min flow rate., 7. Use buffer A as 0.02 M Na2HPO4 in 10% CH3CN ( pH 8.5 ) and buffer B as buffer A plus 1 M NaBr., 8. Combine the pure fractions, concentrate and desalt on a sartorius ultrafiltration station., 9. Confirm the integrities of the purified oligonucleotides by LC-MS and by analytical IEX HPLC., 10. Mix equimolar amounts of complementary sense and antisense strands, anneal by heating to 90 °C and cool slowly., Transfornation (.

I’m so glad you had the patience to read the whole article, if you want know more about 1953146-81-0, you can browse my other blog.. Safety of 1953146-81-0

Reference:
CAS Reaction Number: 31-355-CAS-9994399,
,CAS Method Number: 3-614-CAS-3165786

Safety of 1953146-81-0. Today I’d like to introduce a new chemical compound, CAS is 1953146-81-0, Name is 36-(((2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-21,21-bis((3-((3-(5-(((2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)pentanamido)propyl)amino)-3-oxopropoxy)methyl)-19,26,32-trioxo-4,7,10,13,16,23-hexaoxa-20,27,31-triazahexatriacontan-1-oic acid, Formula is C75H134N10O35, Molecular Weight is 1735.91g/mol. Because of its complex structure and huge molecular weight, this compound is rarely understood. Now let me introduce some knowledge about its synthesis.

The general reactant of this compound is 5-Hexen-1-ol;5H-Pyrano[3,2-d]oxazole-6,7-diol, 5-[(acetyloxy)methyl]-3a,6,7,7a-tetrahydro-2-methyl-, 6,7-diacetate, , Reagents is Trimethylsilyl triflate, Sodium bicarbonate, Catalyst(), Solvent is Dichloromethane, Products β-D-Galactopyranoside, 5-hexen-1-yl 2-(acetylamino)-2-deoxy-, 3,4,6-triacetate, Yield: 82%, Synthetic Methods procedure :1. Stir the reactant ( 642.7 g, 1.95 mol ) in anhydrous 1, 2-dichloroethane ( 4500 mL ) with 4 Å molecular sieves ( 650 g ) for 5 minutes at room temperature., 2. Add 5-Hexen-1-ol ( 215 g, 2.15 mol ) and continue stirring for 30 minutes., 3. Add TMS-triflate ( 180.7 mL, 0.98 mol ) dropwise under constant stirring over 10 minutes and continue stirring for 2 hours at room temperature., 4. Quench the reaction mixture with cold saturated NaHCO3 solution ( 2 L ) and separate the organic layer., 5. Extract the product into dichloromethane ( DCM, 4L ) ; wash the combined organic layers with water, dry over anhydrous Na2SO4 and evaporate to dryness under reduced pressure., 6. Triturate the obtained crude product with hexane ( 6 L ) ; filter the solid and dry under reduced pressure., Transfornation (Alkylation or Silylation of Alcohol with Inorganic/ Organic Esters. Characterization Data include ‘s Proton NMR Spectrum : ( 400 MHz, DMSO-d 6 ) : δ 7.80 ( d, J = 9.2 Hz, 1H, NHCOCH3 ) , 5.83-5.72 ( m, 1H, -CH=CH2 ) ; 5.20 ( d, J = 3.4 Hz, 1H, H4 ) ; 5.02-4.91 ( m, 3H, -CH=CH2, H3 ) , 4.47 ( d, J = 8.5 Hz, 1H, H1 ) , 4.06-3.97 ( m, 3H, H5, H6, H6′ ) ; 3.86 ( dt, J = 8.8, 11.1 Hz, 1H, H2 ) ; 3.70 ( dt, J = 6.0, 9.9 Hz, 1H, -OCH2-CH2 ) ; 3.41 ( dt, J = 6.4, 9.9 Hz, 1H, -OCH2-CH2 ) ; 2.09 ( s, 3H, -COCH3 ) ; 2.03-1.96 ( m, 2H, -CH2- ) ; 1.99 ( s, 3H, -COCH3 ) ; 1.88 ( s, 3H, -COCH3 ) ; 1.75 ( s, 3H, -COCH3 ) ; 1.51-1.42 ( m, 2H, -CH2- ) ; 1.39-1.30 ( m, 2H, -CH2- ) ., Carbon-13 NMR : ( 101 MHz, DMSO-d 6 ) : δ 170.0, 169.9, 169.6, 169.1, 138.7, 114.7, 101.0, 70.4, 69.8, 68.6, 66.7, 61.5, 49.3, 39.9 32.8, 28.4, 24.5, 22.8, 20.5, 20.5., HRMS: calc. for C20H31NO9: 429.1999; found 429.1997., State is pale brown solid

Safety of 1953146-81-0. I’m so glad you had the patience to read the whole article, if you want know more about 1953146-81-0, you can browse my other blog.

Reference:
CAS Reaction Number: 31-355-CAS-9994399,
,CAS Method Number: 3-614-CAS-3165786