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N-Benzoyl-5-methyl-2'-O-methylcytidine

HCID 21782500
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Basic information

CAS
158966-50-8
Standard SMILES
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cc(C)c(NC(=O)c2ccccc2)nc1=O
InChIKey
ZETRQTRYIDJFPT-VMUDFCTBSA-N
Molecular formula
C18H21N3O6
Average molar mass
375.4 g/mol
Monoisotopic mass
375.1430354

Names & identifiers

Preferred name
N-Benzoyl-5-methyl-2'-O-methylcytidine
IUPAC
N-[1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-5-methyl-2-oxopyrimidin-4-yl]benzamide
English name
N4-benzoyl-2'-O-methyl-5-methylcytidine
Molecular formula
C18H21N3O6
Molecular weight
375.38

Names & synonyms

158966-50-8N-Benzoyl-5-methyl-2'-O-methylcytidineN-Benzoyl-5-methyl-2'-O-methyl-CytidineN-(1-((2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxytetrahydrofuran-2-yl)-5-methyl-2-oxo-1,2-dihydropyrimidin-4-yl)benzamideN-[1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-5-methyl-2-oxopyrimidin-4-yl]benzamideN4-benzoyl-2'-O-methyl-5-methylcytidineSCHEMBL2972162DTXSID00617975ZETRQTRYIDJFPT-VMUDFCTBSA-NN-Benzoyl-2'-O-methyl-5-methylcytidineWS-02681E71950
Show more names
CYTIDINE, N-BENZOYL-5-METHYL-2'-O-METHYL-
Cytidine, N-benzoyl-5-methyl-2'-O-methyl- (9CI)

Database identifiers

CAS
158966-50-8
PubChem CID
21782500
DTXSID
DTXSID00617975

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
121 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
27
Formal charge
0
Complexity
643

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Compound notes

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