Basic information
- CAS
223757-03-7- Standard SMILES
COC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(C)nc32)[C@H](O)[C@@H]1O- InChIKey
DSWHUXZDLZEWGB-LSCFUAHRSA-N- Molecular formula
- C17H25N5O4
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.1906543
Names & identifiers
- Preferred name
- n-Cyclopentyl-2-methyl-5'-o-methyladenosine
- IUPAC
- (2R,3R,4S,5R)-2-[6-(cyclopentylamino)-2-methylpurin-9-yl]-5-(methoxymethyl)oxolane-3,4-diol
Names & synonyms
SCHEMBL6660828DTXSID001245778223757-03-7n-cyclopentyl-2-methyl-5'-o-methyladenosineAdenosine, N-cyclopentyl-2-methyl-5a(2)-O-methyl-
Database identifiers
- CAS
223757-03-7- PubChem CID
- 22986937
- DTXSID
DTXSID001245778
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 480
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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