AG007P9G

121058-88-6 | Ac-rC Phosphoramidite

AG007P9G

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CAS Number	121058-88-6
Catalog Number	AG007P9G(AGN-PC-0PFF28)
Chemical Name	Ac-rC Phosphoramidite
IUPAC Name	N-[1-[(2S,3S,4S,5S)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-[tert-butyl(dimethyl)silyl]oxy-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide
InChI	InChI=1S/C47H64N5O9PSi/c1-32(2)52(33(3)4)62(58-30-16-28-48)60-42-40(59-44(43(42)61-63(11,12)46(6,7)8)51-29-27-41(49-34(5)53)50-45(51)54)31-57-47(35-17-14-13-15-18-35,36-19-23-38(55-9)24-20-36)37-21-25-39(56-10)26-22-37/h13-15,17-27,29,32-33,40,42-44H,16,30-31H2,1-12H3,(H,49,50,53,54)/t40-,42-,43-,44-,62?/m0/s1
InChI Key	QKWKXYVKGFKODW-ZYRNLWDWSA-N
MDL Number	MFCD09842111
Molecular Formula	C47H64N5O9PSi
Molecular Weight	902.0984
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=CC(NC(C)=O)=NC5=O)[C@H]1O[Si](C)(C(C)(C)C)C)OCCC#N)C
Synonyms	Ac-rC Phosphoramidite, 121058-88-6, (2S,3S,4S,5S)-5-(4-Acetamido-2-oxopyrimidin-1(2H)-yl)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-((tert-butyldimethylsilyl)oxy)tetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite, CTK8B4329, DTXSID00743122, ANW-44701, AKOS015999121, ZINC169745820, TC-133446, 4-Acetamido-1-(5-O-[bis(4-methoxyphenyl)(phenyl)methyl]-2-O-[tert-butyl(dimethyl)silyl]-3-O-{(2-cyanoethoxy)[di(propan-2-yl)amino]phosphanyl}-beta-L-ribofuranosyl)pyrimidin-2(1H)-one, N-Acetyl-1-[2-O-(tert-butyldimethylsilyl)-3-O-[diisopropylamino(2-cyanoethoxy)phosphino]-5-O-(4,4'-dimethoxytrityl)-beta-L-ribofuranosyl]cytosine,

Complexity	1560
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	901.421g/mol
Formal Charge	0
Heavy Atom Count	63
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	902.114g/mol
Monoisotopic Mass	901.421g/mol
Rotatable Bond Count	21
Topological Polar Surface Area	153A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number