input word = C00012104

Metabolite InformationStructural formula
Name Eupassopilin
Formula C20H26O6
Mw 362.17293856
CAS RN 57718-81-7
C_ID C00012104 ,
InChIKey CQZUJMJORLOTCJ-RMXTVZOSNA-N
InChICode InChI=1S/C20H26O6/c1-11-6-5-8-20(4)17(26-20)16-15(13(3)19(23)25-16)14(10-11)24-18(22)12(2)7-9-21/h6-7,14-17,21H,3,5,8-10H2,1-2,4H3/b11-6+,12-7+/t14-,15-,16+,17+,20-/m1/s1
SMILES C1C[C@@]2([C@H]([C@@H]3[C@@H]([C@@H](C/C(=C/1)/C)OC(=O)/C(=C/CO)/C)C(=C)C(=O)O3)O2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium hyssopifolium Ref.
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