input word = C00022574

Metabolite InformationStructural formula
Name Secoeeniolide
Formula C20H26O6
Mw 362.17293856
CAS RN 129349-97-9
C_ID C00022574 ,
InChIKey OXEYBYROEZOPME-WVGYIFRMNA-N
InChICode InChI=1S/C20H26O6/c1-12(14-10-15(26-18(14)23)13-7-9-25-11-13)6-8-19(2)16(21)4-5-17(22)20(19,3)24/h7,9,11,15,17,22,24H,4-6,8,10H2,1-3H3/b14-12+/t15-,17-,19+,20+/m1/s1
SMILES C1[C@H]([C@]([C@](C(=O)C1)(CC/C(=C\1/C(=O)O[C@H](C1)c1ccoc1)/C)C)(C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePteronia incana Ref.
zoom in