Benzyl-amp
Basic information
- CAS
13484-66-7- Standard SMILES
O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O- InChIKey
DWVANBHPEPSMOV-LSCFUAHRSA-N- Molecular formula
- C17H20N5O7P
- Average molar mass
- 437.3 g/mol
- Monoisotopic mass
- 437.11003499
Overview
N6-Benzyladenosine-5'-phosphate has been reported in Cocos nucifera and Solanum lycopersicum with data available.
Names & identifiers
- Preferred name
- Benzyl-amp
- IUPAC
- [(2R,3S,4R,5R)-5-[6-(benzylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Names & synonyms
13484-66-7Benzyl-ampBenzyl-adenosine monophosphateN(6)-Benzyladenosine-5'-monophosphateRefChem:118921IST5-0025'-Adenylic acid, N-(phenylmethyl)-[(2R,3S,4R,5R)-5-[6-(benzylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphateCHEMBL519155((2R,3S,4R,5R)-5-(6-(Benzylamino)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphaten6-benzyladenosine-5'-monophosphateNSC 255523
Show more names
N6-Benzyladenosine-5'-phosphateN6-Benzyladenosine 5'-monophosphateC17H20N5O7PNSC-255523orb65318SCHEMBL218999orb1226190orb1687548
Database identifiers
- CAS
13484-66-7- PubChem CID
- 59310
- ChEMBL
CHEMBL519155- Nikkaji
- J395.471D
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 172 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 621
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Related reactions
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Compound notes
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