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

CAS No.
56964-73-9
CCD No.
CCD00005501
Formula
C17 H17 N5 O7 S
MolWeight
435.415

Basic Information

Product Name: S-(2-HYDROXY-5-NITROBENZYL)-6-THIOINOSINE
CAS: 56964-73-9
English Synonyms: S-(2-HYDROXY-5-NITROBENZOYL)-6-THIOINOSINE ; S-(2-HYDROXY-5-NITROBENZYL)-6-THIOINOSINE ; 6-[(2-HYDROXY-5-NITROBENZYL)THIO]-9-BETA-D-RIBOFURANOSYLPURINE
MDL Number.: MFCD00005744
H bond acceptor: 12
H bond donor: 4
Smile: c1cc(c(cc1[N+](=O)[O-])CSc2c3c(ncn2)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)O
InChi: InChI=1S/C17H17N5O7S/c23-4-11-13(25)14(26)17(29-11)21-7-20-12-15(21)18-6-19-16(12)30-5-8-3-9(22(27)28)1-2-10(8)24/h1-3,6-7,11,13-14,17,23-26H,4-5H2/t11-,13-,14-,17-/m1/s1
InChiKey: InChIKey=UNTSTPIAQOSGHD-LSCFUAHRSA-N

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