Basic information
- Standard SMILES
Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O- InChIKey
OIRDTQYFTABQOQ-UHFFFAOYSA-N- Molecular formula
- C10H13N5O4
- Average molar mass
- 267.24 g/mol
- Monoisotopic mass
- 267.09675391
Names & identifiers
- Preferred name
- 2-(6-Aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
- IUPAC
- 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
- English name
- L-Adenosine
- Molecular formula
- C10H13N5O4
- Molecular weight
- 267.24
Names & synonyms
2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diolRefChem:10613833228-71-52-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol.beta.-Adenosine123179-97-54005-33-8XylosyladenineMLS000699527Xylosyl AC10H13N5O4NSC70422
Show more names
L-ADENOSINEβ-L-Adenosine(2S,3S,4R,5S)ADA inhibitorBETA-L-ADENOSINEL-Adenosine USP/EP/BPAdenosine Impurity 11-2-(6-Amino-9H-purin-9-yl)9H-Purin-6-amine, 9-β-L-ribofuranosyl-L-ADENOSINE (9-(β-L-RIBOFURANOSYL)ADENINE)
NSC247519SMR000225041.beta.-D-ArabinosyladenineNSC87676; beta-L-Adenosine9.beta.-D-ArabinofuranosyladenineAdenine .beta.-d-arabinofuranoside9-pentofuranosyl-9H-purin-6-amineNSC 7359
Database identifiers
- CAS
2946-52-3、3080-29-3、3228-71-5、4005-33-8、524-69-6、5536-17-4、58-61-7- PubChem CID
- 191
- ChEMBL
CHEMBL11909- ChEBI
CHEBI:93913
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 335
Experimental & physicochemical properties
Solubility>40.1 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 230 °C · 230 °C
- Boiling point
- 676.3 · 676.3±65.0 °C(Predicted)
- Density
- 2.08 · 2.08±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- DMSO (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- pka
- 13.11 · 13.11±0.70(Predicted)
- color
- Off-White
Chemistry & industry
Applications
UsesL-Adenosine is an intermediate in the synthesis of (2S,3S,4R,5R)-2-(6-Amino-9H-purin-9-yl)-5-(((3-aminophenyl)thio)methyl)tetrahydrofuran-3,4-diol (A609900), an enantiomer of (2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-(((3-aminophenyl)thio)methyl)tetrahydrofuran-3,4-diol (A577286), which an intermediate used in the synthesis of S-adenosylhomocysteine analogs with biological activities.
Suppliers1 total
济南尚博生物科技有限公司+8615866703830 · [email protected]
Related reactions
13 records
Linked notes
Loading…