(2R,3R,4S,5R)-2-{6-[hydroxy(methyl)amino]purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diol

AlkaPlorer ID: AK123281

Synonym: None

IUPAC Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[hydroxy(methyl)amino]purin-9-yl]oxolane-3,4-diol

Structure

SMILES: CN(O)C1=C2N=CN([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C2=NC=N1

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InChI: InChI=1S/C11H15N5O5/c1-15(20)9-6-10(13-3-12-9)16(4-14-6)11-8(19)7(18)5(2-17)21-11/h3-5,7-8,11,17-20H,2H2,1H3/t5-,7-,8-,11-/m1/s1

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InChIKey: FSJKXZCUNZIYPF-IOSLPCCCSA-N

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Reference

PubChem CID: 101518

CAS: 17124-28-6

SuperNatural Ⅲ: SN0094289-01

NPASS: NPC265392

Properties Information

Molecule Weight: 297.271

TPSA: 136.99

MolLogP: -1.7368

Number of H-Donors: 4

Number of H-Acceptors: 10

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information