X499960
Xanthinol Nicotinate
| Trivial name | Xanthinol Nicotinate |
| Catalog Number | TRC-X499960-1MG |
| Alternative Name(s) | 7-[2-Hydroxy-3-[N-methyl-N-(2-hydroxyethyl)amino]-propyl]-theophylline Nicotinate; |
| Molecular Formula | C₁₃H₂₁N₅O₄ • C ₆H₅NO₂ |
| CAS# | 437-74-1 |
| Inchi | InChI=1S/C13H21N5O4.C6H5NO2/c1-15(4-5-19)6-9(20)7-18-8-14-11-10(18)12(21)17(3)13(22)16(11)2;8-6(9)5-2-1-3-7-4-5/h8-9,19-20H,4-7H2,1-3H3;1-4H,(H,8,9) |
| SMILES | CN(CC(CN1C=NC(N(C(N2C)=O)C)=C1C2=O)O)CCO.OC(C3=CN=CC=C3)=O |
| Beilstein Registry Number | NA |
| Size | 1mg |
| Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-X499960-1MG |