(Q27467637)

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

9-[(2R,3R,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione

19 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

1 reference

C₁₀H₁₂N₄O₆

1 reference

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

19 October 2016

canonical SMILES

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

1 reference

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

19 October 2016

isomeric SMILES

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

1 reference

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)/t3-,5-,6-,9+/m1/s1

19 October 2016

Identifiers

InChI

1 reference

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

UBORTCNDUKBEOP-BDXYJKHTSA-N

19 October 2016

InChIKey

1 reference

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

19 October 2016

1 reference

9-(alpha-D-Ribofuranosyl)-3,9-dihydro-1H-purine-2,6-dione (English)

19 October 2016

2 references

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione (English)

matched by identifier from

19 October 2016

InChIKey

UBORTCNDUKBEOP-BDXYJKHTSA-N

1 reference

0 references

1 reference

2EG5 (English)