input word = C00042281

Metabolite InformationStructural formula
Name Betulifol A
(+)-Betulifol A
Formula C28H20O6
Mw 452.12598837
CAS RN 219759-04-3
C_ID C00042281 ,
InChIKey IXCJZDPJWABGNK-UEDAADEJNA-N
InChICode InChI=1S/C28H20O6/c29-15-5-1-13(2-6-15)27-25-19-9-17(31)12-22-24(19)26(20-10-18(32)11-21(33-27)23(20)25)28(34-22)14-3-7-16(30)8-4-14/h1-12,25-32H/t25-,26-,27+,28+/m1/s1
SMILES c12c3[C@@H](c4c5[C@@H]1[C@@H](Oc5cc(c4)O)c1ccc(cc1)O)[C@@H](Oc3cc(c2)O)c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis betulifolia Ref.
zoom in