S-(2-HYDROXY-5-NITROBENZYL)-6-THIOGUANOSINE

CAS No.
41094-07-9
CCD No.
CCD00037759
Formula
C17 H18 N6 O7 S
MolWeight
450.43

Basic Information

Product Name: S-(2-HYDROXY-5-NITROBENZYL)-6-THIOGUANOSINE
CAS: 41094-07-9
English Synonyms: S-(2-HYDROXY-5-NITROBENZYL)-6-THIOGUANOSINE ; 2-AMINO-6-[(2-HYDROXY-5-NITROBENZYL)THIO]-9-BETA-D-RIBOFURANOSYLPURINE ; S-(2-HYDROXY-5-NITROBENZOYL)-6-THIOGUANOSINE
MDL Number.: MFCD00055996
H bond acceptor: 13
H bond donor: 5
Smile: c1cc(c(cc1[N+](=O)[O-])CSc2c3c(nc(n2)N)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)O
InChi: InChI=1S/C17H18N6O7S/c18-17-20-14-11(19-6-22(14)16-13(27)12(26)10(4-24)30-16)15(21-17)31-5-7-3-8(23(28)29)1-2-9(7)25/h1-3,6,10,12-13,16,24-27H,4-5H2,(H2,18,20,21)/t10-,12-,13-,16-/m1/s1
InChiKey: InChIKey=JXIKYSYYTDTHBG-XNIJJKJLSA-N

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