2AD
Summary
| Name: | 2'-AMINO-2'-DEOXYADENOSINE |
| Formula: | C10 H14 N6 O3 |
| Formal charge: | 0 |
| Formula weight: | 266.257 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2'-amino-2'-deoxyadenosine |
| OpenEye OEToolkits | 1.5.0 | (2R,3S,4R,5R)-4-amino-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c1c(ncnc1n(c2)C3OC(C(O)C3N)CO)N |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n2cnc3c(N)ncnc23 |
| SMILES | CACTVS | 3.341 | N[CH]1[CH](O)[CH](CO)O[CH]1n2cnc3c(N)ncnc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CO)O)N)N |
| InChI | InChI | 1.03 | InChI=1S/C10H14N6O3/c11-5-7(18)4(1-17)19-10(5)16-3-15-6-8(12)13-2-14-9(6)16/h2-5,7,10,17-18H,1,11H2,(H2,12,13,14)/t4-,5-,7-,10-/m1/s1 |
| InChIKey | InChI | 1.03 | CQKMBZHLOYVGHW-QYYRPYCUSA-N |
