QA2
N-[2-(4-aminophenyl)ethyl]adenosine
Find entries where: QA2
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | N-[2-(4-aminophenyl)ethyl]adenosine |
Identifiers | (2~{R},3~{R},4~{S},5~{R})-2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol |
Formula | C18 H22 N6 O4 |
Molecular Weight | 386.405 |
Type | NON-POLYMER |
Isomeric SMILES | c1cc(ccc1CCNc2c3c(ncn2)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
InChI | InChI=1S/C18H22N6O4/c19-11-3-1-10(2-4-11)5-6-20-16-13-17(22-8-21-16)24(9-23-13)18-15(27)14(26)12(7-25)28-18/h1-4,8-9,12,14-15,18,25-27H,5-7,19H2,(H,20,21,22)/t12-,14-,15-,18-/m1/s1 |
InChIKey | XTPOZVLRZZIEBW-SCFUHWHPSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 50 |
Chiral Atom Count | 4 |
Bond Count | 53 |
Aromatic Bond Count | 16 |
Related Resource References
Resource Name | Reference |
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PubChem | 9952135 |
ChEMBL | CHEMBL1256714 |