Basic Information |
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Product Name: | THYMIDYLYL(3'->5')THYMIDYLYL(3'->5')-2'-DEOXYCYTIDINE DISODIUM SALT |
CAS: | 108347-86-0 |
English Synonyms: | THYMIDYLYL(3'->5')THYMIDYLYL(3'->5')-2'-DEOXYCYTIDINE DISODIUM SALT |
MDL Number.: | MFCD00057459 |
H bond acceptor: | 25 |
H bond donor: | 5 |
Smile: | Cc1cn(c(=O)[nH]c1=O)[C@H]2C[C@@H]([C@H](O2)CO)OP(=O)([O-])OC[C@@H]3[C@H](C[C@@H](O3)n4cc(c(=O)[nH]c4=O)C)OP(=O)([O-])OC[C@@H]5[C@H](C[C@@H](O5)n6ccc(nc6=O)N)O.[Na+].[Na+] |
InChi: | InChI=1S/C29H39N7O18P2.2Na/c1-13-8-35(28(42)32-25(13)39)23-6-16(18(10-37)50-23)53-56(46,47)49-12-20-17(7-24(52-20)36-9-14(2)26(40)33-29(36)43)54-55(44,45)48-11-19-15(38)5-22(51-19)34-4-3-21(30)31-27(34)41;;/h3-4,8-9,15-20,22-24,37-38H,5-7,10-12H2,1-2H3,(H,44,45)(H,46,47)(H2,30,31,41)(H,32,39,42)(H,33,40,43);;/q;2*+1/p-2/t15-,16-,17-,18+,19+,20+,22+,23+,24+;;/m0../s1 |
InChiKey: | InChIKey=ZOAJDWIMGKOPGD-IBDSURBRSA-L |
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