Basic information
- Standard SMILES
C=CCO[C@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1CO- InChIKey
KURUYHOEDIRMCE-QYVSTXNMSA-N- Molecular formula
- C13H17N5O4
- Average molar mass
- 307.31 g/mol
Names & identifiers
- Preferred name
- 3'-O-Allyladenosine
- IUPAC
- (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-prop-2-enoxyoxolan-3-ol
Names & synonyms
3'-O-Allyladenosine400820-99-73'-O-Allyl-D-adenosine3'-O-allyl AdenosineSCHEMBL2255481KURUYHOEDIRMCE-QYVSTXNMSA-NNA06237(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-prop-2-enoxyoxolan-3-ol(2R,3R,4S,5R)-4-allyloxy-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3-ol
Database identifiers
- PubChem CID
- 11001292
- Nikkaji
- J2.739.101J
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 401
Related reactions
7 records
Compound notes
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