input word = C00054345

Metabolite InformationStructural formula
Name 6-Butyryl-5,7-dihydroxy-8-isopentenyl-4-propylcoumarin.
Formula C21H26O5
Mw 358.17802394
CAS RN 38537-84-7
C_ID C00054345
InChIKey HDHKEYMZRICGLG-UHFFFAOYSA-N
InChICode InChI=1S/C21H26O5/c1-5-7-13-11-16(23)26-21-14(10-9-12(3)4)19(24)18(15(22)8-6-2)20(25)17(13)21/h9,11,24-25H,5-8,10H2,1-4H3
SMILES OC1=C(C(O)=C(C(CCC)=CC(O2)=O)C2=C1C/C=C(C)C)C(CCC)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae-GuttiferaeMammea americana Ref.
zoom in