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5-Methyl dCMP

HCID 102276
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2498-41-1
Standard SMILES
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1N
InChIKey
RGDVNLHBCKWZDA-XLPZGREQSA-N
Molecular formula
C10H16N3O7P
Average molar mass
321.22 g/mol
Monoisotopic mass
321.07258686

Overview

2'-deoxy-5-methyl-5'-cytidylic acid is a pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having 5-methylcytidine as the nucleobase. It is a pyrimidine 2'-deoxyribonucleoside 5'-monophosphate and a 2'-deoxycytidine phosphate. It is a conjugate acid of a 2'-deoxy-5-methyl-5'-cytidylate(2-).

Names & identifiers

Preferred name
5-Methyl dCMP
IUPAC
[(2R,3S,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate
English name
2'-deoxy-5-methylcytidine 5'-monophosphate
Molecular formula
C10H16N3O7P
Molecular weight
321.22

Names & synonyms

2498-41-1Deoxy-5-methylcytidylic acid5-Methyl-deoxycytidylic acidDTXSID901796935-methyldeoxycytidine 5'-monophosphate5-Methyl dCMP5MedCMPRefChem:913517DTXCID50102184219-690-15-Methyl-2'-deoxycytidine 5'-monophosphate2'-Deoxy-5-methylcytidine 5'-monophosphate
Show more names
5-mdCMP5-MedCTEinecs 219-690-15-Methyl-2'-deoxy-5'-cytidylic acid
2'-deoxy-5-methyl-5'-cytidylic acid5'-Cytidylic acid, 2'-deoxy-5-methyl-5-Methyl-2'-deoxycytidine5'-monophosphate2'-deoxy-5-methylcytidine 5'-(dihydrogen phosphate)((2R,3S,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate[(2R,3S,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE5-MedCTP

Database identifiers

CAS
2498-41-1
PubChem CID
102276

Properties

Computed structural propertiesFilling in

XLogP
-3
Topological polar surface area
155 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
543

Physicochemical properties

storage temp.
-20 °C · Sealed in dry,Store in freezer, under -20°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Additional notes

DefinitionChEBI: A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having 5-methylcytidine as the nucleobase.

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Compound notes

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DTXSID
DTXSID90179693
ChEBI
CHEBI:16764
EC Number
219-690-1
Nikkaji
J191.991A