Basic information
- CAS
49815-30-7- Standard SMILES
Nc1ncnc2c1ncn2C1CC(COP(=O)(O)O)C(O)C1O- InChIKey
ZLHJFTIXCUYZSQ-UHFFFAOYSA-N- Molecular formula
- C11H16N5O6P
- Average molar mass
- 345.25 g/mol
- Monoisotopic mass
- 345.08382024
Names & identifiers
- Preferred name
- [4-(6-Aminopurin-9-yl)-2,3-dihydroxy-cyclopentyl]methoxyphosphonic acid
- IUPAC
- [4-(6-aminopurin-9-yl)-2,3-dihydroxycyclopentyl]methyl dihydrogen phosphate
Names & synonyms
49815-30-71,2-Cyclopentanediol, 3-(6-amino-9H-purin-9-yl)-5-[(phosphonooxy)methyl]-NSC133716DTXSID70299924[4-(6-aminopurin-9-yl)-2,3-dihydroxy-cyclopentyl]methoxyphosphonic acidNSC-133716DS-007900[4-(6-Amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]methyl dihydrogen phosphate
Database identifiers
- CAS
49815-30-7- PubChem CID
- 281157
- DTXSID
DTXSID70299924
Properties
Computed structural properties
- XLogP
- -2.9
- Topological polar surface area
- 177 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 480
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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