CAS 1298086-17-5 appears in our catalog under these names: Ertugliflozin Impuity 3, Ertugliflozin Impurity 6, Ertugliflozin Impurity 4. Offered by: Chemat Brand, Hubei YoungXin. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.
(1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-hydroxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol (CAS 1298086-17-5) is a chemical compound with the molecular formula C20H21ClO7 and a molecular weight of 408.8 g/mol. IUPAC name: (1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-hydroxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol. InChIKey: UHORDSFKUFJGMW-KNJMJIDISA-N.
| Molecular formula | C20H21ClO7 |
|---|---|
| Molecular weight | 408.8 g/mol |
| IUPAC name | (1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-hydroxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol |
| InChIKey | UHORDSFKUFJGMW-KNJMJIDISA-N |
| SMILES | C1[C@]2([C@H]([C@@H]([C@H]([C@@](O1)(O2)C3=CC(=C(C=C3)Cl)CC4=CC=C(C=C4)O)O)O)O)CO |
Computed by PubChem (NCBI)