Basic information
- CAS
75421-11-3- Standard SMILES
O=C1NCC=CCN1[C@@H]1OC(CO)[C@@H](O)[C@H]1O- InChIKey
HBBIVXDEBCKFIZ-FUZJYRNYSA-N- Molecular formula
- C10H16N2O5
- Average molar mass
- 244.24 g/mol
- Monoisotopic mass
- 244.10592162
Overview
structure given in first source
Names & identifiers
- Preferred name
- Diazepinone riboside
- IUPAC
- 3-[(2R,3R,4S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,7-dihydro-1H-1,3-diazepin-2-one
Names & synonyms
Diazepinone riboside75421-11-3RefChem:920021NSC 322096DS-0132622H-1,3-Diazepin-2-one, 1,3,4,6-tetrahydro-1-beta-D-ribofuranosyl-2H-1,3-diazepin-2-one,1,3,4,6-tetrahydro-1-b-d-ribofuranosyl-(9ci)
Database identifiers
- CAS
75421-11-3- PubChem CID
- 100583
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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