9-(6-Deoxyhexofuranosyl)-9h-purin-6-amine

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Basic information

CAS: 29847-43-6
Standard SMILES: CC(O)C1OC(n2cnc3c(N)ncnc32)C(O)C1O
InChIKey: DJUZHNZMVHIRPJ-UHFFFAOYSA-N
Molecular formula: C11H15N5O4
Average molar mass: 281.27 g/mol
Monoisotopic mass: 281.11240398

Names & identifiers

Preferred name: 9-(6-Deoxyhexofuranosyl)-9h-purin-6-amine
IUPAC: 2-(6-aminopurin-9-yl)-5-(1-hydroxyethyl)oxolane-3,4-diol

Names & synonyms

35868-16-79-(6-deoxyhexofuranosyl)-9h-purin-6-amineSCHEMBL21413837DTXSID60952298(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(1-hydroxyethyl)oxolane-3,4-diol(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-[(1R)-1-hydroxyethyl]oxolane-3,4-diol(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-[(1S)-1-hydroxyethyl]oxolane-3,4-diolNSC18193NSC23113NSC23613NSC28102NSC-18193

Show more names

NSC-23113NSC-23613NSC-28102NSC515360NSC-51536057237-22-66974-24-9

Database identifiers

CAS: 29847-43-6、3253-81-4、35868-16-7、57237-22-6、6974-24-9
PubChem CID: 227045
DTXSID: DTXSID60952298

Properties

Computed structural properties

XLogP: -0.6
Topological polar surface area: 140 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 8
Rotatable bonds: 2
Heavy atoms: 20
Formal charge: 0
Complexity: 362

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Compound notes

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