Basic information
- CAS
15023-72-0- Standard SMILES
Nc1ncnc2c1ncn2C1SC(CO)C(O)C1O- InChIKey
SIGIJBMOORTVPB-UHFFFAOYSA-N- Molecular formula
- C10H13N5O3S
- Average molar mass
- 283.31 g/mol
- Monoisotopic mass
- 283.07391047
Names & identifiers
- Preferred name
- 9-(4-Thiopentofuranosyl)-9h-purin-6-amine
- IUPAC
- 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)thiolane-3,4-diol
Names & synonyms
15023-72-09-(4-thiopentofuranosyl)-9h-purin-6-amineDTXSID70933896(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)thiolane-3,4-diol15023-73-12500-79-0NSC81154NSC82219NSC97111NSC-81154NSC-82219NSC-97111
Show more names
NSC109160NSC110342NSC-109160NSC-110342PD201660
Database identifiers
- CAS
15023-72-0、15023-73-1、15023-77-5、2500-79-0、2500-80-3- PubChem CID
- 98140
- DTXSID
DTXSID70933896
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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