input word = C00010053

Metabolite InformationStructural formula
Name Bavacoumestan A
Formula C20H16O6
Mw 352.09468824
CAS RN 129385-63-3
C_ID C00010053 ,
InChIKey RPMMXKVPBSLSDA-UHFFFAOYNA-N
InChICode InChI=1S/C20H16O6/c1-20(2)16(22)6-9-5-12-15(8-13(9)26-20)24-18-11-4-3-10(21)7-14(11)25-19(23)17(12)18/h3-5,7-8,16,21-22H,6H2,1-2H3/t16-/m1/s1
SMILES c1(ccc2c(c1)oc(=O)c1c2oc2c1cc1c(c2)OC([C@@H](C1)O)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePsoralea corylifolia Ref.
zoom in