DMT-2'Fluoro-DG(IB) Amidite

• CAS: 144089-97-4
• Catalog Number: ACM144089974
• Category: Amidites
• Molecular Weight: 857.91
• Molecular Formula: C44H53FN7O8P
• Synonyms: (2R,3R,4R,5R)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-fluoro-5-(2-isobutyramido-6-oxo-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-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]-6-oxo-1H-purin-2-yl]-2-methylpropanamide
• 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=C5N=C(NC(C(C)C)=O)NC6=O)[C@@H]1F)OCCC#N)C
• InChI: 1S/C44H53FN7O8P/c1-27(2)40(53)49-43-48-39-37(41(54)50-43)47-26-51(39)42-36(45)38(60-61(58-24-12-23-46)52(28(3)4)29(5)6)35(59-42)25-57-44(30-13-10-9-11-14-30,31-15-19-33(55-7)20-16-31)32-17-21-34(56-8)22-18-32/h9-11,13-22,26-29,35-36,38,42H,12,24-25H2,1-8H3,(H2,48,49,50,53,54)/t35-,36-,38-,42-,61?/m1/s1
• InChI Key: KJFUMXZZVYMQEU-AOCJBPQJSA-N
• Storage: Sealed in dry, store in freezer, under -20°C
• Complexity: 1480
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 4
• Defined Bond Stereocenter Count: 0
• EC Number: 890-260-9
• Formal Charge: 0
• H-Bond Acceptor: 13
• H-Bond Donor: 2
• Heavy Atom Count: 61
• Isomeric SMILES: CC(C)C(=O)NC1=NC2=C(C(=O)N1)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OP(N(C(C)C)C(C)C)OCCC#N)F
• MDL Number: MFCD12912415
• PubChem ID: 135448972
• Rotatable Bond Count: 19
• Undefined Atom Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0