Products 468733-06-4
CAS 468733-06-4 is the registry number for Cimilactone A. Offered by: Biosynth, MedChemExpress. Available pack sizes: 10mg, 25mg, 50mg, 5 mg, 1 mg, 25 mg, 10 mg.
[(1R,3R,4R,5R,6R,10S,12S,13S,16R,18S,21R)-4,6,12,17,17-pentamethyl-8-oxo-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-3-yl] acetate (CAS 468733-06-4) is a chemical compound with the molecular formula C33H50O9 and a molecular weight of 590.7 g/mol. IUPAC name: [(1R,3R,4R,5R,6R,10S,12S,13S,16R,18S,21R)-4,6,12,17,17-pentamethyl-8-oxo-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-3-yl] acetate. InChIKey: RKTWPXXLEHCPIO-DWWJFHMPSA-N.
| Molecular formula | C33H50O9 |
|---|---|
| Molecular weight | 590.7 g/mol |
| IUPAC name | [(1R,3R,4R,5R,6R,10S,12S,13S,16R,18S,21R)-4,6,12,17,17-pentamethyl-8-oxo-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-3-yl] acetate |
| InChIKey | RKTWPXXLEHCPIO-DWWJFHMPSA-N |
| SMILES | C[C@@H]1CC(=O)O[C@@H]2[C@H]1[C@]3([C@@H](C[C@@]45C[C@@]46CC[C@@H](C([C@@H]6CC[C@H]5[C@@]3(C2)C)(C)C)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)OC(=O)C)C |
Computed by PubChem (NCBI)
Synonyms:
Cimilactone A, orb1984213