CAS 134954-57-7 is the registry number for Taccalonolide E, 95.14%. Offered by: MedChemExpress. Available pack sizes: 1 mg, 5 mg.
[(1S,2R,3R,5S,7S,9S,10R,11R,12S,14S,15R,16S,17S,22S,23S,24R,25R)-10,25-diacetyloxy-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.02,12.05,11.07,9.016,24.019,23]pentacos-18-en-14-yl] acetate (CAS 134954-57-7) is a chemical compound with the molecular formula C34H44O12 and a molecular weight of 644.7 g/mol. IUPAC name: [(1S,2R,3R,5S,7S,9S,10R,11R,12S,14S,15R,16S,17S,22S,23S,24R,25R)-10,25-diacetyloxy-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.02,12.05,11.07,9.016,24.019,23]pentacos-18-en-14-yl] acetate. InChIKey: QPGVBFHVYONDKH-DSDDZLSXSA-N.
| Molecular formula | C34H44O12 |
|---|---|
| Molecular weight | 644.7 g/mol |
| IUPAC name | [(1S,2R,3R,5S,7S,9S,10R,11R,12S,14S,15R,16S,17S,22S,23S,24R,25R)-10,25-diacetyloxy-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.02,12.05,11.07,9.016,24.019,23]pentacos-18-en-14-yl] acetate |
| InChIKey | QPGVBFHVYONDKH-DSDDZLSXSA-N |
| SMILES | C[C@@H]1C=C2[C@@]([C@H]3[C@H]1[C@]4([C@H](C[C@H]5[C@H]([C@@H]4[C@H]3OC(=O)C)[C@H](C(=O)[C@@H]6[C@@]5([C@H]([C@@H]7[C@H](C6)O7)OC(=O)C)C)O)OC(=O)C)C)([C@](C(=O)O2)(C)O)C |
Computed by PubChem (NCBI)