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UNA-A(Bz)-CE Phosphoramidite

Catalog NumberCDMO1120329523

CAS Number1120329-52-3

CategoryPhosphoramidites

Synonyms N6-Benzoyl-5'-(4,4'-dimethoxytrityl)-2'-benzoyl-2',3'-seco-adenosine-3'-cyanoethyl Phosphoramidite
IUPAC Name [(2R)-2-(6-Benzamidopurin-9-yl)-2-[(2R)-1-[bis(4-methoxyphenyl)-phenylmethoxy]-3-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxypropan-2-yl]oxyethyl] benzoate
Molecular Weight 980.05
Molecular Formula C54H58N7O9P
Canonical SMILES CC(C)N(C(C)C)P(OCCC#N)OCC(COC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)OC(COC(=O)C4=CC=CC=C4)N5C=NC6=C(N=CN=C65)NC(=O)C7=CC=CC=C7
InChI InChI=1S/C54H58N7O9P/c1-38(2)61(39(3)4)71(68-32-16-31-55)69-34-47(33-67-54(42-21-14-9-15-22-42,43-23-27-45(64-5)28-24-43)44-25-29-46(65-6)30-26-44)70-48(35-66-53(63)41-19-12-8-13-20-41)60-37-58-49-50(56-36-57-51(49)60)59-52(62)40-17-10-7-11-18-40/h7-15,17-30,36-39,47-48H,16,32-35H2,1-6H3,(H,56,57,59,62)/t47-,48-,71?/m1/s1
InChI Key DETQAICZNNZAEM-OWWCMFKUSA-N
Purity HPLC ≥98%
Storage -20 °C
Complexity 1590
Exact Mass 979.40336345
Form White to off-white powder
Heavy Atom Count 71
Isomeric SMILES CC(C)N(C(C)C)P(OCCC#N)OC[C@@H](COC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)O[C@H](COC(=O)C4=CC=CC=C4)N5C=NC6=C(N=CN=C65)NC(=O)C7=CC=CC=C7
Monoisotopic Mass 979.40336345
Topological Polar Surface Area 181Ų

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