Scientific information on chemical compounds included in crude drugs
Chikusetsusaponin III
|
| Molecular formula | C47H80O17 |
| Average molecular mass (Molecular weight) |
917.1 |
| Exact molecular mass | 916.539551 |
| [M+H]+ | 917.547 |
| [M-H]- | 915.532 |
| CAS | |
| NIKKAJI | |
| PUBCHEM No. | 46173930 |
| Crude drug | Panax Japonicus Rhizome |
| IUPAC_NAME | (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-2-[[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-12-hydroxy-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol |
| Remarks | InChIKey (PubChem): ZICDJKZDHVLVOD-HUGMCNGHSA-N |
