Products 1393890-33-9
CAS 1393890-33-9 appears in our catalog under these names: Tacrolimus EP Impurity F, Tacrolimus Impurity 16, Tacrolimus Ring-opening Impurity 1, Tacrolimus Impurity 14（Tacrolimus EP Impurity F）（Tacrolimus Ring-opening Impurity）. Offered by: Chemat Brand, Hubei YoungXin. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.
(5R,7S,8R,9S,11S,13E,15R,18S,19R,20S,23S)-8,18-dihydroxy-20-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-7,9-dimethoxy-5,11,13,19-tetramethyl-15-prop-2-enyl-21-oxa-1-azabicyclo[21.4.0]heptacos-13-ene-2,3,4,16,22-pentone (CAS 1393890-33-9) is a chemical compound with the molecular formula C44H69NO12 and a molecular weight of 804.0 g/mol. IUPAC name: (5R,7S,8R,9S,11S,13E,15R,18S,19R,20S,23S)-8,18-dihydroxy-20-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-7,9-dimethoxy-5,11,13,19-tetramethyl-15-prop-2-enyl-21-oxa-1-azabicyclo[21.4.0]heptacos-13-ene-2,3,4,16,22-pentone. InChIKey: ZPKGWFOANXPORW-RCRFZRKUSA-N.
| Molecular formula | C44H69NO12 |
|---|---|
| Molecular weight | 804.0 g/mol |
| IUPAC name | (5R,7S,8R,9S,11S,13E,15R,18S,19R,20S,23S)-8,18-dihydroxy-20-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-7,9-dimethoxy-5,11,13,19-tetramethyl-15-prop-2-enyl-21-oxa-1-azabicyclo[21.4.0]heptacos-13-ene-2,3,4,16,22-pentone |
| InChIKey | ZPKGWFOANXPORW-RCRFZRKUSA-N |
| SMILES | C[C@@H]1C[C@@H]([C@H]([C@H](C[C@H](C(=O)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]([C@@H]([C@H](CC(=O)[C@@H](/C=C(/C1)\C)CC=C)O)C)/C(=C/[C@@H]3CC[C@H]([C@@H](C3)OC)O)/C)C)OC)O)OC |
Computed by PubChem (NCBI)