input word = C00020579

Metabolite InformationStructural formula
Name Hieracin I
Formula C15H20O5
Mw 280.13107375
CAS RN 117259-18-4
C_ID C00020579 ,
InChIKey PNJPRRXAWYTOOM-DQTYGXTDNA-N
InChICode InChI=1S/C15H20O5/c1-7-9-3-4-15(2,19)12-10(17)5-8(6-16)11(12)13(9)20-14(7)18/h5,7,9,11-13,16,19H,3-4,6H2,1-2H3/t7-,9-,11-,12+,13-,15-/m0/s1
SMILES C1=C([C@H]2[C@@H](C1=O)[C@@](CC[C@@H]1[C@@H]2OC(=O)[C@H]1C)(C)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelminthotheca echioides (L.) Holub Ref.
PlantaeAsteraceaePicris hieracioides Ref.
PlantaeAsteraceaePicris hieracioides L.var.japonica Regel Ref.
zoom in



OrganismPicris hieracioides L.var.japonica Regel
ReferenceZidorn,Phytochem.,69,(2008),2270