(2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-{[(3-nitrobenzyl)disulfanyl]methyl}tetrahydrofuran-3,4-diol (Q27457134)

CHEMBL1230737 (English)

19 October 2016

chemical formula

C₁₇H₁₈N₆O₅S₂

1 reference

CHEMBL1230737 (English)

19 October 2016

canonical SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSSCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O

1 reference

CHEMBL1230737 (English)

19 October 2016

isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSSC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=CN=C4N)O)O

1 reference

CHEMBL1230737 (English)

InChI=1S/C17H18N6O5S2/c18-15-12-16(20-7-19-15)22(8-21-12)17-14(25)13(24)11(28-17)6-30-29-5-9-2-1-3-10(4-9)23(26)27/h1-4,7-8,11,13-14,17,24-25H,5-6H2,(H2,18,19,20)/t11-,13-,14-,17-/m1/s1

19 October 2016

Identifiers

InChI

1 reference

CHEMBL1230737 (English)

UWYQTICCMFSWOE-LSCFUAHRSA-N

19 October 2016

InChIKey

1 reference

CHEMBL1230737 (English)

19 October 2016

1 reference

(2R,3R,4S,5S)-2-(6-Amino-9H-purin-9-yl)-5-{[(3-nitrobenzyl)disulfanyl]methyl}tetrahydro-3,4-furandiol (English)

19 October 2016

1 reference

CHEMBL1230737 (English)

19 October 2016

1 reference

CHEMBL1230737 (English)

19 October 2016

1 reference

0 references

1 reference

3IOD (English)