input word = C00020952

Metabolite InformationStructural formula
Name Ferulin
Formula C15H16O3
Mw 244.10994438
CAS RN 29455-13-8
C_ID C00020952 ,
InChIKey FRBORWNVTCITAQ-MBQVVBHTNA-N
InChICode InChI=1S/C15H16O3/c1-7-4-12(16)14-8(2)5-13-11(6-10(7)14)9(3)15(17)18-13/h4,6,9,11,13H,5H2,1-3H3/t9-,11+,13-/m0/s1
SMILES C12=C(C[C@H]3[C@H](C=C1C(=CC2=O)C)[C@@H](C(=O)O3)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula oopoda Ref.
zoom in