Structure

DMT-dT Phosphoramidite

CAS
98796-51-1
Catalog Number
ACM98796511-1
Category
Amidites
Molecular Weight
744.81
Molecular Formula
C40H49N4O8P

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Specification

Synonyms
(2R,3S,5R)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite
IUPAC Name
3-[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile
SMILES
O=C(NC(C(C)=C1)=O)N1[C@H](O2)C[C@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@H]2COC(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChI
1S/C40H49N4O8P/c1-27(2)44(28(3)4)53(50-23-11-22-41)52-35-24-37(43-25-29(5)38(45)42-39(43)46)51-36(35)26-49-40(30-12-9-8-10-13-30,31-14-18-33(47-6)19-15-31)32-16-20-34(48-7)21-17-32/h8-10,12-21,25,27-28,35-37H,11,23-24,26H2,1-7H3,(H,42,45,46)/t35-,36+,37+,53?/m0/s1
InChI Key
UNOTXUFIWPRZJX-CEXSRUIHSA-N
Storage
Sealed in dry, 2-8°C
Complexity
1240
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
3
Defined Bond Stereocenter Count
0
EC Number
685-410-3
Formal Charge
0
H-Bond Acceptor
10
H-Bond Donor
1
Heavy Atom Count
53
Isomeric SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)OP(N(C(C)C)C(C)C)OCCC#N
MDL Number
MFCD00055063
PubChem ID
9940288
Pubchem SID
488196452
Rotatable Bond Count
17
Undefined Atom Stereocenter Count
1
Undefined Bond Stereocenter Count
0

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