F7X
Summary
| Name: | [(2R)-2-[2-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)ethanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate |
| Formula: | C10 H15 N6 O7 P |
| Formal charge: | 0 |
| Formula weight: | 362.236 Da |
| Component type: | DNA linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [(2~{R})-2-[2-(2-azanyl-6-oxidanylidene-1~{H}-purin-9-yl)ethanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H15N6O7P/c11-10-14-8-7(9(19)15-10)12-4-16(8)1-6(18)13-5(2-17)3-23-24(20,21)22/h4-5,17H,1-3H2,(H,13,18)(H2,20,21,22)(H3,11,14,15,19)/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | UGPARWCAUBOAFC-RXMQYKEDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC1=Nc2n(CC(=O)N[C@H](CO)CO[P](O)(O)=O)cnc2C(=O)N1 |
| SMILES | CACTVS | 3.385 | NC1=Nc2n(CC(=O)N[CH](CO)CO[P](O)(O)=O)cnc2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1nc2c(n1CC(=O)N[C@H](CO)COP(=O)(O)O)N=C(NC2=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1nc2c(n1CC(=O)NC(CO)COP(=O)(O)O)N=C(NC2=O)N |
