arabinosyl-N(6)-hydroxyadenine-9-beta-D-arabinofuranosyl-6-hydroxylaminopurine
Basic information
- CAS
24822-51-3- Standard SMILES
OC[C@H]1O[C@@H](n2cnc3c(NO)ncnc32)[C@@H](O)[C@@H]1O- InChIKey
QROZCFCNYCVEDO-UHTZMRCNSA-N- Molecular formula
- C10H13N5O5
- Average molar mass
- 283.24 g/mol
- Monoisotopic mass
- 283.09166853
Overview
adenosine deaminase inhibitor; structure
Names & identifiers
- Preferred name
- arabinosyl-N(6)-hydroxyadenine-9-beta-D-arabinofuranosyl-6-hydroxylaminopurine
- IUPAC
- (2R,3S,4S,5R)-2-[6-(hydroxyamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
Ara-HA24822-51-36H-Purin-6-one, 9-beta-D-arabinofuranosyl-1,9-dihydro-, oximeArabinosyl-N(6)-hydroxyadenine-9-beta-D-arabinofuranosyl-6-hydroxylaminopurineRefChem:113667NSC 126876Adenine, N-hydroxy-9-beta-D-arabinofuranosyl-(2R,3S,4S,5R)-2-[6-(hydroxyamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diolSCHEMBL6342419CHEMBL23112019-|A-D-Arabinofuranosyl-N-hydroxy-9H-purin-6-amine
Database identifiers
- CAS
24822-51-3- PubChem CID
- 97480
- ChEMBL
CHEMBL2311201- Nikkaji
- J88.298D
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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