AG0009ZI

113886-71-8 | Cytidine, N-acetyl-2'-O-methyl-

AG0009ZI

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CAS Number	113886-71-8
Catalog Number	AG0009ZI(AGN-PC-0NYBID)
Chemical Name	Cytidine, N-acetyl-2'-O-methyl-
IUPAC Name	N-[1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide
InChI	InChI=1S/C12H17N3O6/c1-6(17)13-8-3-4-15(12(19)14-8)11-10(20-2)9(18)7(5-16)21-11/h3-4,7,9-11,16,18H,5H2,1-2H3,(H,13,14,17,19)/t7-,9-,10-,11-/m1/s1
InChI Key	CYDFBLGNJUNSCC-QCNRFFRDSA-N
MDL Number	MFCD15145149
Molecular Formula	C12H17N3O6
Molecular Weight	299.2799
SMILES	OC[C@@H]1[C@H]([C@H]([C@H](N2C(N=C(C=C2)NC(C)=O)=O)O1)OC)O
Synonyms	113886-71-8, Ac-2'-OMe-C, N4-ACETYL-2'-O-METHYL-CYTIDINE, N4-Acetyl-2'-O-methylcytidine, Cytidine,N-acetyl-2'-O-methyl-, N4-Acetyl-2'-O-methyl cytidine, MFCD15145149, Cytidine, N-acetyl-2'-O-methyl-, Ac-2-OMe-C, N-Acetyl-2'-O-methylcytidine, SCHEMBL3499005, CTK4A8501, DTXSID00447815, CYDFBLGNJUNSCC-QCNRFFRDSA-N, N4 -acetyl-2'-O-methyl cytidine, HG1334, ZINC34556412, AKOS015899633, ST24045894, K-1012, J-700206, I14-11183, I14-32546, N-(1-((2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxytetrahydrofuran-2-yl)-2-oxo-1,2-dihydropyrimidin-4-yl)acetamide, Ac-2/'-OMe-C, CID10902616, CID 10902616,

Complexity	491
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	299.112g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	299.283g/mol
Monoisotopic Mass	299.112g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	121A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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