Basic information
- CAS
32476-37-2- Standard SMILES
OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O- InChIKey
BBOCDRLDMQHWJP-WOUKDFQISA-N- Molecular formula
- C12H17N5O5
- Average molar mass
- 311.29 g/mol
- Monoisotopic mass
- 311.12296866
Overview
(2R,3R,4S,5R)-2-(6-((2-Hydroxyethyl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol has been reported in Isaria japonica, Cordyceps pruinosa, and Micromeles japonica with data available.
Names & identifiers
- Preferred name
- N6-(2-hydroxyethyl)adenosine
- IUPAC
- (2R,3R,4S,5R)-2-[6-(2-hydroxyethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
4338-48-1n6-(2-hydroxyethyl)adenosineRefChem:927411(2R,3R,4S,5R)-2-(6-((2-Hydroxyethyl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diolN-(2-Hydroxyethyl)adenosineMFCD00056977Adenosine, N-(2-hydroxyethyl)-SCHEMBL899687(2R,3R,4S,5R)-2-[6-(2-hydroxyethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diolPDSP2_0010126-(2-Hydroxyethyl)amino-9-beta-D-ribofuranosylpurineDS-4131
Show more names
AC-3234832476-37-2n-(2-hydroxyethyl)-9-pentofuranosyl-9h-purin-6-amine6-Hydroxyethyladenosine; 6-[(2-Hydroxyethyl)amino]-9-beta-D-ribofuranosylpurine; N6-(2-Hydroxyethyl)adenosine; NSC 54251;N-hydroxyethyl adenosineA855704orb1741474orb2900190
Database identifiers
- CAS
32476-37-2、4338-48-1- PubChem CID
- 96124
- DTXSID
DTXSID50954221- ChEMBL
CHEMBL4755693- Nikkaji
- J152.380E
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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