Scientific information on chemical compounds included in crude drugs
Amarogentin
|
| Molecular formula | C29H30O13 |
| Average molecular mass (Molecular weight) |
586.5 |
| Exact molecular mass | 586.168641 |
| [M+H]+ | 587.176 |
| [M-H]- | 585.161 |
| CAS | |
| NIKKAJI | |
| PUBCHEM No. | 115149 |
| Crude drug | Gentian,Swertia Herb |
| IUPAC_NAME | [(2S,3R,4S,5S,6R)-2-[[(3S,4R,4aS)-4-ethenyl-8-oxo-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 2,4-dihydroxy-6-(3-hydroxyphenyl)benzoate |
| Remarks | InChIKey (PubChem): DBOVHQOUSDWAPQ-WTONXPSSSA-N |
