Showing Metabocard for 5'-pApG-3' (BASm0010044)
| Common Name | 5'-papg-3' |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C20H23N10O14P2 |
| Average Mass | 689.40900 |
| Monoisotopic Mass | 689.08869 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)([O-])O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c(=O)[nH]1 |
| InChI Identifier | InChI=1S/C20H26N10O14P2/c21-14-8-15(24-3-23-14)29(4-25-8)19-12(33)13(7(43-19)2-40-45(35,36)37)44-46(38,39)41-1-6-10(31)11(32)18(42-6)30-5-26-9-16(30)27-20(22)28-17(9)34/h3-7,10-13,18-19,31-33H,1-2H2,(H,38,39)(H2,21,23,24)(H2,35,36,37)(H3,22,27,28,34)/p-3/t6-,7-,10-,11-,12-,13-,18-,19-/m1/s1 |
| InChI Key | SXJAFMAZBFVAJD-INFSMZHSSA-K |
| CHEBI ID | CHEBI:142752 |
| MiMeDB ID | MMDBc0055591 |
| State | Expected Solid |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |