DMT-2'fluoro-da(bz) amidite

• CAS: 136834-22-5
• Catalog Number: ACM136834225
• Category: Amidites
• Molecular Weight: 875.92
• Molecular Formula: C47H51FN7O7P
• Synonyms: (2R,3R,4R,5R)-5-(6-benzamido-9H-purin-9-yl)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-fluorotetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite
• IUPAC Name: N-[9-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-3-fluorooxolan-2-yl]purin-6-yl]benzamide
• SMILES: CC(N(C(C)C)P(O[C@@H]1[C@@H](COC(C2=CC=C(OC)C=C2)(C3=CC=C(OC)C=C3)C4=CC=CC=C4)O[C@@H](N5C=NC6=C(NC(C7=CC=CC=C7)=O)N=CN=C56)[C@@H]1F)OCCC#N)C
• InChI: 1S/C47H51FN7O7P/c1-31(2)55(32(3)4)63(60-27-13-26-49)62-42-39(61-46(40(42)48)54-30-52-41-43(50-29-51-44(41)54)53-45(56)33-14-9-7-10-15-33)28-59-47(34-16-11-8-12-17-34,35-18-22-37(57-5)23-19-35)36-20-24-38(58-6)25-21-36/h7-12,14-25,29-32,39-40,42,46H,13,27-28H2,1-6H3,(H,50,51,53,56)/t39-,40-,42-,46-,63?/m1/s1
• InChI Key: VCCMVPDSLHFCBB-MSIRFHFKSA-N
• Storage: Inert atmosphere, store in freezer, under -20°C
• Complexity: 1420
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 4
• Defined Bond Stereocenter Count: 0
• EC Number: 890-259-3
• Formal Charge: 0
• H-Bond Acceptor: 13
• H-Bond Donor: 1
• Heavy Atom Count: 63
• Isomeric SMILES: CC(C)N(C(C)C)P(OCCC#N)O[C@@H]1[C@H](O[C@H]([C@@H]1F)N2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC
• MDL Number: MFCD12912392
• PubChem ID: 12042896
• Rotatable Bond Count: 19
• Undefined Atom Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0