For research use only. Not for therapeutic Use.
| Catalog Number | M110912 |
| CAS Number | 129391-97-5 |
| Synonyms | 5-azido-2-nitrobenzoyl-8-azido ATP |
| Molecular Formula | C17H17N12O16P3 |
| Purity | ≥95% |
| Storage | -20°C |
| IUPAC Name | [(2R,3S,4R,5R)-5-(6-amino-8-azidopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 5-azido-2-nitrobenzoate |
| InChI | InChI=1S/C17H17N12O16P3/c18-13-10-14(22-5-21-13)28(17(23-10)25-27-20)15-11(30)12(43-16(31)7-3-6(24-26-19)1-2-8(7)29(32)33)9(42-15)4-41-47(37,38)45-48(39,40)44-46(34,35)36/h1-3,5,9,11-12,15,30H,4H2,(H,37,38)(H,39,40)(H2,18,21,22)(H2,34,35,36)/t9-,11-,12-,15-/m1/s1 |
| InChIKey | WQKDGRLVQXNEBZ-SDBHATRESA-N |
| SMILES | C1=CC(=C(C=C1N=[N+]=[N-])C(=O)OC2C(OC(C2O)N3C4=C(C(=NC=N4)N)N=C3N=[N+]=[N-])COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[N+](=O)[O-] |
