Basic Information |
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| Product Name: | 3-DEAZA-DA CEP |
| CAS: | 666257-76-7 |
| English Synonyms: | 3-DEAZA-DA CEP ; 3-DEAZA-2'-DEOXYADENOSINE 3'-CE PHOSPHORAMIDITE |
| MDL Number.: | MFCD08062069 |
| H bond acceptor: | 13 |
| H bond donor: | 1 |
| Smile: | CC(C)N(C(C)C)P(OCCC#N)O[C@H]1C[C@@H](O[C@@H]1COC(c2ccccc2)(c3ccc(cc3)OC)c4ccc(cc4)OC)n5cnc6c5ccnc6NC(=O)c7ccccc7 |
| InChi: | InChI=1S/C48H53N6O7P/c1-33(2)54(34(3)4)62(59-29-13-27-49)61-42-30-44(53-32-51-45-41(53)26-28-50-46(45)52-47(55)35-14-9-7-10-15-35)60-43(42)31-58-48(36-16-11-8-12-17-36,37-18-22-39(56-5)23-19-37)38-20-24-40(57-6)25-21-38/h7-12,14-26,28,32-34,42-44H,13,29-31H2,1-6H3,(H,50,52,55)/t42-,43+,44+,62?/m0/s1 |
| InChiKey: | InChIKey=KANZRWOEDDAVIO-IHHNYUCOSA-N |
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