Products 2227484-71-9
CAS 2227484-71-9 is the registry number for ETD001, 98.85%. Offered by: MedChemExpress. Available pack sizes: 10 mg, 5 mg, 1 mg.
3-amino-N-[[5-[4-[bis[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]piperidine-1-carbonyl]-1,3-diethylbenzimidazol-1-ium-2-yl]methyl]-5H-pyrrolo[2,3-b]pyrazine-2-carboxamide;2,2,2-trifluoroacetate;2,2,2-trifluoroacetic acid (CAS 2227484-71-9) is a chemical compound with the molecular formula C41H57F6N9O16 and a molecular weight of 1045.9 g/mol. IUPAC name: 3-amino-N-[[5-[4-[bis[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]piperidine-1-carbonyl]-1,3-diethylbenzimidazol-1-ium-2-yl]methyl]-5H-pyrrolo[2,3-b]pyrazine-2-carboxamide;2,2,2-trifluoroacetate;2,2,2-trifluoroacetic acid. InChIKey: KMKTYTISJOKXPA-NKVRUFHASA-N.
| Molecular formula | C41H57F6N9O16 |
|---|---|
| Molecular weight | 1045.9 g/mol |
| IUPAC name | 3-amino-N-[[5-[4-[bis[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]piperidine-1-carbonyl]-1,3-diethylbenzimidazol-1-ium-2-yl]methyl]-5H-pyrrolo[2,3-b]pyrazine-2-carboxamide;2,2,2-trifluoroacetate;2,2,2-trifluoroacetic acid |
| InChIKey | KMKTYTISJOKXPA-NKVRUFHASA-N |
| SMILES | CCN1C2=C(C=CC(=C2)C(=O)N3CCC(CC3)N(C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)[N+](=C1CNC(=O)C4=NC5=C(NC=C5)N=C4N)CC.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)[O-] |
Computed by PubChem (NCBI)
Synonyms:
orb2814312