1-(2-O-Methyl-beta-D-arabinofuranosyl)cytosine
Basic information
- CAS
35819-07-9- Standard SMILES
CO[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O- InChIKey
RFCQJGFZUQFYRF-BUJSFMDZSA-N- Molecular formula
- C10H15N3O5
- Average molar mass
- 257.24 g/mol
- Monoisotopic mass
- 257.10117059
Overview
structure
Names & identifiers
- Preferred name
- 1-(2-O-Methyl-beta-D-arabinofuranosyl)cytosine
- IUPAC
- 4-amino-1-[(2R,3S,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]pyrimidin-2-one
Names & synonyms
1-(2-O-Methyl-beta-D-arabinofuranosyl)cytosineRefChem:7420235819-07-9NSC 178026SCHEMBL37179262(1H)-pyrimidinone, 4-amino-1-(2-O-methyl-b-D-arabinofuranosyl)-2(1H)-Pyrimidinone, 4-amino-1-(2-O-methyl-beta-D-arabinofuranosyl)-4-amino-1-[(2R,3S,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]pyrimidin-2-one
Database identifiers
- CAS
35819-07-9- PubChem CID
- 98913
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 397
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Compound notes
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