input word = C00041967

Metabolite InformationStructural formula
Name Xanthopappin C
Formula C27H20O3S2
Mw 456.08538596
CAS RN 905305-06-8
C_ID C00041967 ,
InChIKey YIPZRWXKZQNUSS-YDFGWWAZNA-N
InChICode InChI=1S/C27H20O3S2/c1-4-6-8-10-12-14-22-16-18-24(31-22)26(29)27(30,20-21(3)28)25-19-17-23(32-25)15-13-11-9-7-5-2/h4-7,16-19,30H,20H2,1-3H3/b6-4+,7-5+/t27-/m1/s1
SMILES s1c(ccc1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeXanthopappus subacaulis Ref.
zoom in