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| Standard English name | |
|---|---|
| Cas No. | 115288-28-3 |
| Alias | (((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methyl diphosphoric) (4R)-4-((8R,9S,10R,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic anhydride |
| Canonical Smiles | C[C@H](CCC(=O)OP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC(O)[C@@]21C |
| MDL No. | |
| Exact Mass | 877.24654 |
| Smiles | C[C@@H]([C@H]1CC[C@@H]2[C@]1(C)C(O)C[C@H]3[C@H]2CCC4=CC(CC[C@]34C)=O)CCC(OP(O)(OP(O)(OC[C@@H]5[C@@H](OP(O)(O)=O)[C@@H](O)[C@H](N6C=NC7=C(N)N=CN=C76)O5)=O)=O)=O |
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| Inchi | InChI=1S/C34H50N5O16P3/c1-17(21-7-8-22-20-6-5-18-12-19(40)10-11-33(18,2)23(20)13-25(41)34(21,22)3)4-9-26(42)53-58(49,50)55-57(47,48)51-14-24-29(54-56(44,45)46)28(43)32(52-24)39-16-38-27-30(35)36-15-37-31(27)39/h12,15-17,20-25,28-29,32,41,43H,4-11,13-14H2,1-3H3,(H,47,48)(H,49,50)(H2,35,36,37)(H2,44,45,46)/t17-,20+,21-,22+,23+,24-,25?,28-,29-,32-,33+,34-/m1/s1 |
| InchiKey | LZZSDQZZUZSFMG-SWQQIEAQSA-N |
| Remark |
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