input word = C00056855

Metabolite InformationStructural formula
Name Panaxfurayne A
Formula C23H32O12
Mw 500.18937649
CAS RN 1115052-75-9
C_ID C00056855
InChIKey GKMJBKTWUROSQB-FGPVRZRUSA-N
InChICode InChI=1S/C23H32O12/c1-2-3-4-5-6-8-23(9-7-10-31-23)35-22-20(18(29)16(27)14(12-25)33-22)34-21-19(30)17(28)15(26)13(11-24)32-21/h2-3,13-22,24-30H,7,9-12H2,1H3/b3-2+/t13-,14-,15-,16-,17+,18+,19-,20-,21+,22+,23?/m1/s1
SMILES O[C@H]([C@H]1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[C@H]1OC3(C#CC#C/C=C/C)CCCO3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
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OrganismPanax ginseng
ReferenceLee, S.M. et al., Tet. Lett., 2009, 50, 416-418 (isol, pmr, cmr)