input word = C00046974

Metabolite InformationStructural formula
Name Wattersiixanthone A
(-)-Wattersiixanthone A
Formula C25H28O13
Mw 536.15299098
CAS RN 292135-84-3
C_ID C00046974 ,
InChIKey WKNUCCYIYBTPQS-NSCXFFFLNA-N
InChICode InChI=1S/C25H28O13/c1-33-14-3-2-4-15-17(14)18(27)12-7-11(5-6-13(12)37-15)36-23-21(30)20(29)19(28)16(38-23)8-34-24-22(31)25(32,9-26)10-35-24/h2-7,16,19-24,26,28-32H,8-10H2,1H3/t16-,19-,20+,21-,22+,23-,24-,25-/m1/s1
SMILES COc1cccc2oc3ccc(O[C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3c(=O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaePolygala wattersii Ref.
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