AG004WKC

838-07-3 | 5-Methyl-2'-deoxycytidine

AG004WKC

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CAS Number	838-07-3
Catalog Number	AG004WKC(AGN-PC-0OIWJA)
Chemical Name	5-Methyl-2'-deoxycytidine
EC Number	212-655-1
IUPAC Name	4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
InChI	InChI=1S/C10H15N3O4/c1-5-3-13(10(16)12-9(5)11)8-2-6(15)7(4-14)17-8/h3,6-8,14-15H,2,4H2,1H3,(H2,11,12,16)/t6-,7+,8+/m0/s1
InChI Key	LUCHPKXVUGJYGU-XLPZGREQSA-N
MDL Number	MFCD00006549
Molecular Formula	C10H15N3O4
Molecular Weight	241.2438
SMILES	O=c1n([C@@H]2O[C@@H]([C@H](C2)O)CO)cc(c(n1)N)C
Synonyms	5-methyl-2'-deoxycytidine, 5-methyldeoxycytidine, 5-Methyl-2'-deoxycytidine, 838-07-3, 2'-Deoxy-5-methylcytidine, 5-Methyldeoxycytidine, UNII-B200GV71QM, CYTIDINE, 2'-DEOXY-5-METHYL-, 4-Amino-1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidin-2(1H)-one, B200GV71QM, CHEMBL1234242, CHEBI:47876, MFCD00006549, EINECS 212-655-1, 4-Amino-1-(4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidin-2-one, BRN 0024189, AK-72796, 5-mdC, 1-(2-Deoxy-beta-D-ribofuranosyl)-5-methylcytosine, 5-Methyl-2-deoxycytidine, SCHEMBL20268, 4-25-00-03727 (Beilstein Handbook Reference), AC1L98L4, CHEMBL159023, CTK8B2388, KS-00000FYZ, LUCHPKXVUGJYGU-XLPZGREQSA-N, BCP12372, ZINC1303441, ZX-AT015545, ANW-37726, BDBM50028592, CM-783, GE5158, HG1109, KM2180, AKOS015841918, AKOS015896924, AC-8204, CS-W012794, EBD2205147, OR40355, AJ-25350, BR-72796, DS-15250, SC-19595, ZB016255, AB0012470, AX8012281, DB-056746, TL8005496, TR-026016, D3610, FT-0633023, ST24029518, C03592, 838M073, 5-Methyl-2 inverted exclamation marka-deoxycytidine, J-700035, 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one, 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidin-2-one, 5CM, MCY, C10H15N3O4, CID440055, C10-H15-N3-O4, 2'-Deoxy-5-methylcytidine, 98% - 100MG 100mg, 5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE, N/A,

Complexity	393
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	241.106g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	241.247g/mol
Monoisotopic Mass	241.106g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	108A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.4

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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