Name: | CGS 21680 |
CAS: | 120225-54-9 ;124182-57-6 |
Synonyms: | BENZENEPROPANOIC ACID, 4-[2-[[6-AMINO-9-(N-ETHYL-B-D-RIBOFURANURONAMIDOSYL)-9H-PURIN-2-YL]AMINO]ETHYL]-, MONOHYDROCHLORIDE, HYDRATE ; CGS 21680 |
MDL.: | MFCD00877010 |
H bond acceptor: | 13 |
H bond donor: | 6 |
Smile: | CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2nc(nc3N)NCCc4ccc(cc4)CCC(=O)O)O)O |
InChi: | InChI=1S/C23H29N7O6/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29)/t16-,17+,18-,22+/m0/s1 |
InChiKey: | InChIKey=PAOANWZGLPPROA-RQXXJAGISA-N |
CGS 21680
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