Molecular Identity
Deoxycytidine
4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
PubChem CID: 13711
2'-deoxycytidine is a pyrimidine 2'-deoxyribonucleoside having cytosine as the nucleobase. It has a role as a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a human metabolite. It is functionally related to a cytosine.
2D Structure
Properties
C9H13N3O4
Molecular Formula
227.22
Molecular Weight
g/mol
227.0906
Exact Mass
Da
-1.8
XLogP
Drug-like (Lipinski: < 5)
108
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
355
Complexity
SMILES
Canonical SMILES
SMILES: C1C(C(OC1N2C=CC(=NC2=O)N)CO)OIsomeric SMILES
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)CO)OSynonyms(20)
2'-deoxycytidine951-77-9deoxycytidineCYTIDINE, 2'-DEOXY-Deoxyribose cytidineCytosine deoxyribosidedCYDDoxecitineDesoxycytidinCytosine, deoxyribonucleoside4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one0W860991D6CHEBI:15698DTXSID70883620MT-1621 COMPONENT 2'-DEOXYCYTIDINE
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Deoxycytidine
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