input word = C00004810

Metabolite InformationStructural formula
Name 5-O-Demethylapulein
Formula C19H18O9
Mw 390.09508217
CAS RN 20398-48-5
C_ID C00004810 ,
InChIKey KMDMMDZJQFJXCU-UHFFFAOYSA-N
InChICode InChI=1S/C19H18O9/c1-24-11-6-9(20)8(5-10(11)21)17-19(27-4)16(23)14-12(28-17)7-13(25-2)18(26-3)15(14)22/h5-7,20-22H,1-4H3
SMILES c1(c(c(c2c(c1)oc(c(c2=O)OC)c1cc(c(cc1O)OC)O)O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGutierrezia microcephala Ref.
PlantaeFabaceaeApuleia leiocarpa Ref.
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