78V
4-[2-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylamino]ethylamino]-1-(methoxymethyl)pyrimidin-2-one
Find entries where: 78V
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 4-[2-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylamino]ethylamino]-1-(methoxymethyl)pyrimidin-2-one |
Identifiers | 4-[2-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylamino]ethylamino]-1-(methoxymethyl)pyrimidin-2-one |
Formula | C18 H25 N9 O5 |
Molecular Weight | 447.448 |
Type | NON-POLYMER |
Isomeric SMILES | COCN1C=CC(=NC1=O)NCCNC[C@@H]2[C@H]([C@H]([C@@H](O2)n3cnc4c3ncnc4N)O)O |
InChI | InChI=1S/C18H25N9O5/c1-31-9-26-5-2-11(25-18(26)30)21-4-3-20-6-10-13(28)14(29)17(32-10)27-8-24-12-15(19)22-7-23-16(12)27/h2,5,7-8,10,13-14,17,20,28-29H,3-4,6,9H2,1H3,(H2,19,22,23)(H,21,25,30)/t10-,13-,14-,17-/m1/s1 |
InChIKey | ZZOHCVFRIAWCAC-IWCJZZDYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 57 |
Chiral Atom Count | 4 |
Bond Count | 60 |
Aromatic Bond Count | 10 |
Related Resource References
Resource Name | Reference |
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PubChem | 129900329 |