Scientific information on chemical compounds included in crude drugs
Amaroswerin
Molecular formula | C29H30O14 |
Average molecular mass (Molecular weight) |
602.5 |
Exact molecular mass | 602.163556 |
[M+H]+ | 603.171 |
[M-H]- | 601.156 |
CAS | |
NIKKAJI | |
PUBCHEM No. | 45359883 |
Crude drug | Swertia Herb |
IUPAC_NAME | [(2S,3R,4S,5S,6R)-2-[[(3S,4R,4aR)-4-ethenyl-4a-hydroxy-8-oxo-3,4,5,6-tetrahydropyrano[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): UZYZCCWBBBCDAD-WCYQFIIKSA-N |