T96
N-[(4-aminophenyl)methyl]adenosine
Find entries where: T96
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | N-[(4-aminophenyl)methyl]adenosine |
| Identifiers | (2~{R},3~{R},4~{S},5~{R})-2-[6-[(4-aminophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol |
| Formula | C17 H20 N6 O4 |
| Molecular Weight | 372.379 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(ccc1CNc2c3c(ncn2)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
| InChI | InChI=1S/C17H20N6O4/c18-10-3-1-9(2-4-10)5-19-15-12-16(21-7-20-15)23(8-22-12)17-14(26)13(25)11(6-24)27-17/h1-4,7-8,11,13-14,17,24-26H,5-6,18H2,(H,19,20,21)/t11-,13-,14-,17-/m1/s1 |
| InChIKey | PMUVNAUPWLXPSA-LSCFUAHRSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 47 |
| Chiral Atom Count | 4 |
| Bond Count | 50 |
| Aromatic Bond Count | 16 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 125347 |
| ChEMBL | CHEMBL259188 |
