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Details

Stereochemistry EPIMERIC
Molecular Formula C44H53FN7O8P
Molecular Weight 857.9059
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DMT-2'-Fluoro-dG(Ib) Phosphoramidite

SMILES

COC1=CC=C(C=C1)C(OC[C@H]2O[C@H]([C@H](F)[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)N3C=NC4=C3NC(NC(=O)C(C)C)=NC4=O)(C5=CC=CC=C5)C6=CC=C(OC)C=C6

InChI

InChIKey=KJFUMXZZVYMQEU-AOCJBPQJSA-N
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

HIDE SMILES / InChI

Molecular Formula C44H53FN7O8P
Molecular Weight 857.9059
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
T97KRQ76SF
Record Status Validated (UNII)
Record Version