input word = C00019930

Metabolite InformationStructural formula
Name 8-Hydroxytriptiliocoumarin
Formula C25H30O4
Mw 394.21440945
CAS RN 118555-92-3
C_ID C00019930 ,
InChIKey YYTDIFAVQFQGAJ-BVNMTLBRNA-N
InChICode InChI=1S/C25H30O4/c1-7-25(6)14-18(13-16(4)10-8-9-15(2)3)28-23-20-17(5)11-12-19(26)22(20)29-24(27)21(23)25/h7,9,11-13,18,26H,1,8,10,14H2,2-6H3/b16-13+/t18-,25+/m1/s1
SMILES C=C[C@@]1(C)CC(/C=C(C)CCC=C(C)C)Oc2c1c(=O)oc1c(O)ccc(C)c21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTriptilion benaventei Ref.
zoom in