3-(6-Aminopurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol

HCID 2235

Notes Reactions

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Basic information

CAS: 19186-33-5
Standard SMILES: Nc1ncnc2c1ncn2C1CC(CO)C(O)C1O
InChIKey: UGRNVLGKAGREKS-UHFFFAOYSA-N
Molecular formula: C11H15N5O3
Average molar mass: 265.27 g/mol
Monoisotopic mass: 265.11748936

Names & identifiers

Preferred name: 3-(6-Aminopurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol
IUPAC: 3-(6-aminopurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol

Names & synonyms

3-(6-aminopurin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol3-(6-amino-9h-purin-9-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol(1R,2S,3R,5R)-3-(6-Amino-9H-purin-9-yl)-5-(hydroxymethyl)-1,2-cyclopentanediolNSC103526NSC613806NSC613807NSC615828Carbocyclic Lyxo-ACarbocyclic Xylo-ACyclaradine Carbocyclic Ara ASCHEMBL9820408DTXSID30940824

Show more names

NSC-103526NSC-613806NSC-613807NSC-615828

Database identifiers

CAS: 19186-33-5
PubChem CID: 2235
DTXSID: DTXSID30940824

Properties

Computed structural properties

XLogP: -0.5
Topological polar surface area: 130 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 7
Rotatable bonds: 2
Heavy atoms: 19
Formal charge: 0
Complexity: 333

Related reactions

1 records

New reaction record

HRID 2315324As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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