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2-azanyl-9-[(2R,3R,4R)-4-(hydroxymethyl)-3-oxidanyl-oxetan-2-yl]-3H-purin-6-one

2-azanyl-9-[(2R,3R,4R)-4-(hydroxymethyl)-3-oxidanyl-oxetan-2-yl]-3H-purin-6-one

Systemtic Name:2-azanyl-9-[(2R,3R,4R)-4-(hydroxymethyl)-3-oxidanyl-oxetan-2-yl]-3H-purin-6-one
Openeye Name:2-amino-9-[(2R,3R,4R)-3-hydroxy-4-(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one
CAS Name:2-amino-9-[(2R,3R,4R)-3-hydroxy-4-(hydroxymethyl)-2-oxetanyl]-3H-purin-6-one
IUPAC Name:2-amino-9-[(2R,3R,4R)-3-hydroxy-4-(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one
Traditional Name:2-amino-9-[(2R,3R,4R)-3-hydroxy-4-methylol-oxetan-2-yl]-3H-purin-6-one
Formula: C9H11N5O4
MolecularWeight: 253.21474
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(O3)CO)O)NC(=NC2=O)N


Isomeric SMILES

C1=NC2=C(N1[C@H]3[C@@H]([C@H](O3)CO)O)NC(=NC2=O)N


InChI

InChI=1S/C9H11N5O4/c10-9-12-6-4(7(17)13-9)11-2-14(6)8-5(16)3(1-15)18-8/h2-3,5,8,15-16H,1H2,(H3,10,12,13,17)/t3-,5-,8-/m1/s1


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