Basic information
- CAS
444020-62-6- Standard SMILES
CO[C@@H]1[C@H](N)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21- InChIKey
VIEMRHCKBJXZFL-HUKYDQBMSA-N- Molecular formula
- C11H16N6O3
- Average molar mass
- 280.28 g/mol
- Monoisotopic mass
- 280.12838839
Names & identifiers
- Preferred name
- Adenosine, 3'-amino-3'-deoxy-2'-O-methyl-
- IUPAC
- [(2S,3R,4R,5R)-3-amino-5-(6-aminopurin-9-yl)-4-methoxyoxolan-2-yl]methanol
Names & synonyms
444020-62-6((2S,3R,4R,5R)-3-Amino-5-(6-amino-9H-purin-9-yl)-4-methoxytetrahydrofuran-2-yl)methanolAdenosine, 3'-amino-3'-deoxy-2'-O-methyl-SCHEMBL1738483DTXSID20431892[(2S,3R,4R,5R)-3-amino-5-(6-amino-9H-purin-9-yl)-4-methoxyoxolan-2-yl]methanol3'-amino-3'-deoxy-2'-o-methyladenosine
Database identifiers
- CAS
444020-62-6- PubChem CID
- 9856930
- DTXSID
DTXSID20431892
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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