input word = C00059310

Metabolite InformationStructural formula
Name 3-Feruloylquinic acid lactone
Formula C17H18O8
Mw 350.10016755
CAS RN 1161849-62-2
C_ID C00059310
InChIKey KFVJGWDDYWUTHM-AWOKGZDASA-N
InChICode InChI=1S/C17H18O8/c1-23-11-6-9(2-4-10(11)18)3-5-14(19)24-12-7-17(22)8-13(15(12)20)25-16(17)21/h2-6,12-13,15,18,20,22H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1
SMILES COc1cc(C=CC(=O)OC2CC3(O)CC(OC3=O)C2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Caffea sp. Ref.
zoom in