Scientific information on chemical compounds included in crude drugs
Scandoside methyl ester
|
| Molecular formula | C17H24O11 |
| Average molecular mass (Molecular weight) |
404.4 |
| Exact molecular mass | 404.131862 |
| [M+H]+ | 405.14 |
| [M-H]- | 403.124 |
| CAS | |
| NIKKAJI | |
| PUBCHEM No. | 442433 |
| Crude drug | Gardenia Fruit |
| IUPAC_NAME | methyl (1S,4aS,5R,7aS)-5-hydroxy-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate |
| Remarks | InChIKey (PubChem): WSGPLSDARZNMCW-LPGRTNKPSA-N |
