input word = C00049157

Metabolite InformationStructural formula
Name Eremopetasitenin D3
(+)-Eremopetasitenin D3
Formula C17H26O5
Mw 310.17802394
CAS RN 202916-96-9
C_ID C00049157 ,
InChIKey JCGMJARSAZGXHM-ZIBCSSEDNA-N
InChICode InChI=1S/C17H26O5/c1-9-13-14(20-4)16(3)10(2)12(18)7-6-11(16)8-17(13,21-5)22-15(9)19/h10-12,14,18H,6-8H2,1-5H3/t10-,11+,12-,14+,16-,17-/m0/s1
SMILES CO[C@@H]1C2=C(C)C(=O)O[C@@]2(OC)C[C@H]2CC[C@H](O)[C@H](C)[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePetasites japonicus Ref.
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