input word = C00003169

Metabolite InformationStructural formula
Name Petasin
Formula C20H28O3
Mw 316.20384476
CAS RN 26577-85-5
C_ID C00003169 ,
InChIKey ISTBXSFGFOYLTM-HGHBEFIINA-N
InChICode InChI=1S/C20H28O3/c1-7-13(4)19(22)23-18-9-8-15-10-17(21)16(12(2)3)11-20(15,6)14(18)5/h7,10,14,16,18H,2,8-9,11H2,1,3-6H3/b13-7-/t14-,16-,18+,20+/m0/s1
SMILES C=C(C)[C@@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C(C)=CC)[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePetasites hybridus Ref.
PlantaeAsteraceaePetasites japonicus Ref.
PlantaeAsteraceaePetasites officinalis Ref.
zoom in



OrganismPetasites japonicus
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979).

Sun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998)