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9H-Purin-6-amine, 9-(3-deoxy-3-(4-morpholinyl)-beta-D-arabinofuranosyl)-

HCID 452767
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Basic information

CAS
134934-81-9
Standard SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](N2CCOCC2)[C@@H]1O
InChIKey
HWVDLADUAKNDAS-GCDPNZCJSA-N
Molecular formula
C14H20N6O4
Average molar mass
336.35 g/mol
Monoisotopic mass
336.15460314

Names & identifiers

Preferred name
9H-Purin-6-amine, 9-(3-deoxy-3-(4-morpholinyl)-beta-D-arabinofuranosyl)-
IUPAC
(2R,3S,4S,5S)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-morpholin-4-yloxolan-3-ol

Names & synonyms

3'-Morpholino-dA3'-Morpholino-3'-deoxyadenosine134934-81-99H-Purin-6-amine, 9-(3-deoxy-3-(4-morpholinyl)-beta-D-arabinofuranosyl)-DTXSID701591159-[3-Deoxy-3-(morpholin-4-yl)-beta-D-arabinofuranosyl]-9H-purin-6-amine(2R,3S,4S,5S)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-morpholino-tetrahydrofuran-3-ol9H-Purin-6-amine, 9-[3-deoxy-3-(4-morpholinyl)-.beta.-D-arabinofuranosyl]-

Database identifiers

CAS
134934-81-9
PubChem CID
452767
DTXSID
DTXSID70159115
Nikkaji
J363.912F

Properties

Computed structural properties

XLogP
-1.3
Topological polar surface area
132 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
9
Rotatable bonds
3
Heavy atoms
24
Formal charge
0
Complexity
439

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Compound notes

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