AG00033R

100898-63-3 | Cytidine, N-acetyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-

AG00033R

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CAS Number	100898-63-3
Catalog Number	AG00033R(AGN-PC-0NV374)
Chemical Name	Cytidine, N-acetyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-
IUPAC Name	N-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide
InChI	InChI=1S/C32H33N3O7/c1-21(36)33-29-17-18-35(31(38)34-29)30-19-27(37)28(42-30)20-41-32(22-7-5-4-6-8-22,23-9-13-25(39-2)14-10-23)24-11-15-26(40-3)16-12-24/h4-18,27-28,30,37H,19-20H2,1-3H3,(H,33,34,36,38)/t27-,28+,30+/m0/s1
InChI Key	FHZQVUQHQIUSPM-PKZQBKLLSA-N
MDL Number	MFCD05663669
Molecular Formula	C32H33N3O7
Molecular Weight	571.6203
SMILES	CC(NC(C=CN1[C@@H]2O[C@H](COC(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5)[C@@H](O)C2)=NC1=O)=O
Synonyms	100898-63-3, 5'-O-(4,4'-DIMETHOXYTRITYL)-N4-ACETYL-2'-DEOXYCYTIDINE, N-Acetyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-cytidine, N-(1-((2R,4S,5R)-5-((Bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-hydroxytetrahydrofuran-2-yl)-2-oxo-1,2-dihydropyrimidin-4-yl)acetamide, N4-Acetyl-2'-deoxy-5'-O-DMT-cytidine, J-700203, C32H33N3O7, FHZQVUQHQIUSPM-PKZQBKLLSA-N, N-Acetyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxycytidine, Cytidine,N-acetyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-, N-Acetyl-5'-DMTdeoxycytidine, Cytidine, N-acetyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-, SCHEMBL20596260, CTK4B2162, 0291AA, ANW-64060, MFCD05663669, ZINC100035683, AK-54686, RT-004387, FT-0689196, ST24044017, ST24048256, K-0198, 5-O-(4,4-Dimethoxytrityl)-N4-acetyl-2-deoxycytidine, N4-acetyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxycytidine, N-Acetyl-5\\'-O-(4,4\\'-dimethoxytrityl)-2\\'-deoxycytidine, 5'-DMT-Ac-rC, CID11146222, CID 11146222, 121058-82-0,

Complexity	957
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	571.232g/mol
Formal Charge	0
Heavy Atom Count	42
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	571.63g/mol
Monoisotopic Mass	571.232g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	119A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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