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| Standard English name | |
|---|---|
| Cas No. | 1197993-19-3 |
| Alias | (2R,3S,5R)-5-(8-(3-acetylphenyl)-2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-2-(((6-(4-(((3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl)oxy)methyl)-1H-1,2,3-triazol-1-yl)hexanoyl)oxy)methyl)tetrahydrofuran-3-yl 6-(4-(((3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl)oxy)methyl)-1H-1,2,3-triazol-1-yl)hexanoate |
| Canonical Smiles | CC(=O)C1=CC(=CC=C1)C1=NC2=C(N=C(N)NC2=O)N1[C@H]1C[C@H](OC(=O)CCCCCN2C=C(COC(=O)C(C)(CO)CO)N=N2)[C@@H](COC(=O)CCCCCN2C=C(COC(=O)C(C)(CO)CO)N=N2)O1 |
| MDL No. | |
| Exact Mass | 1,007.43486 |
| Smiles | O=C1C2=C(N(C(C3=CC=CC(C(C)=O)=C3)=N2)[C@H](O4)C[C@H](OC(CCCCCN5N=NC(COC(C(C)(CO)CO)=O)=C5)=O)[C@H]4COC(CCCCCN6N=NC(COC(C(C)(CO)CO)=O)=C6)=O)N=C(N)N1 |
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| Inchi | InChI=1S/C46H61N11O15/c1-28(62)29-11-10-12-30(17-29)39-48-38-40(49-44(47)50-41(38)65)57(39)35-18-33(72-37(64)14-7-5-9-16-56-20-32(52-54-56)22-70-43(67)46(3,26-60)27-61)34(71-35)23-68-36(63)13-6-4-8-15-55-19-31(51-53-55)21-69-42(66)45(2,24-58)25-59/h10-12,17,19-20,33-35,58-61H,4-9,13-16,18,21-27H2,1-3H3,(H3,47,49,50,65)/t33-,34+,35+/m0/s1 |
| InchiKey | KWASOLCQPPRIEZ-BMPTZRATSA-N |
| Remark |
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