F7O
Summary
| Name: | [(2R)-2-[2-(6-aminopurin-9-yl)ethanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate |
| Formula: | C10 H15 N6 O6 P |
| Formal charge: | 0 |
| Formula weight: | 346.236 Da |
| Component type: | DNA linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [(2~{R})-2-[2-(6-aminopurin-9-yl)ethanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H15N6O6P/c11-9-8-10(13-4-12-9)16(5-14-8)1-7(18)15-6(2-17)3-22-23(19,20)21/h4-6,17H,1-3H2,(H,15,18)(H2,11,12,13)(H2,19,20,21)/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | QTPOROPTULPLNT-ZCFIWIBFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ncnc2n(CC(=O)N[C@H](CO)CO[P](O)(O)=O)cnc12 |
| SMILES | CACTVS | 3.385 | Nc1ncnc2n(CC(=O)N[CH](CO)CO[P](O)(O)=O)cnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1nc(c2c(n1)n(cn2)CC(=O)N[C@H](CO)COP(=O)(O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1nc(c2c(n1)n(cn2)CC(=O)NC(CO)COP(=O)(O)O)N |
