input word = C00004814

Metabolite InformationStructural formula
Name Apulein
Formula C20H20O9
Mw 404.11073224
CAS RN 20362-24-7
C_ID C00004814 ,
InChIKey GSDPDMPAMXKDMZ-UHFFFAOYSA-N
InChICode InChI=1S/C20H20O9/c1-24-12-7-10(21)9(6-11(12)22)17-20(28-5)16(23)15-13(29-17)8-14(25-2)18(26-3)19(15)27-4/h6-8,21-22H,1-5H3
SMILES c1(c(c(c2c(c1)oc(c(c2=O)OC)c1cc(c(cc1O)OC)O)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeApuleia leiocarpa Ref.
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