8-hydroxy-2,3,6,7,8,9-hexahydro-1H-purine-2,6-dione

AlkaPlorer ID: AK081434

Synonym: None

IUPAC Name: (8S)-8-hydroxy-3,7,8,9-tetrahydropurine-2,6-dione

Structure

SMILES: OC1=NC2=C(N[C@H](O)N2)C(O)=N1

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InChI: InChI=1S/C5H6N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h4,6,11H,(H3,7,8,9,10,12)/t4-/m0/s1

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InChIKey: KYKVXIJTQOYZLY-BYPYZUCNSA-N

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Reference

PubChem CID: 49766623

NPASS: NPC263451

Properties Information

Molecule Weight: 170.128

TPSA: 110.53000000000002

MolLogP: -0.9989000000000006

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information