input word = C00020500

Metabolite InformationStructural formula
Name Eupachifolin C
Formula C22H26O7
Mw 402.16785319
CAS RN 72947-96-7
C_ID C00020500 ,
InChIKey RGSSIOXOYJIMTR-DROMKICFNA-N
InChICode InChI=1S/C22H26O7/c1-10(6-7-23)21(25)28-16-8-11(2)17-15(27-14(5)24)9-12(3)18(17)20-19(16)13(4)22(26)29-20/h6,9,15-20,23H,2,4,7-8H2,1,3,5H3/b10-6+/t15-,16+,17+,18-,19+,20+/m0/s1
SMILES C=C1C[C@@H](OC(=O)/C(C)=C/CO)[C@H]2C(=C)C(=O)O[C@@H]2[C@H]2C(C)=C[C@@H](OC(C)=O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium chinense Ref.
PlantaeAsteraceaeEupatorium glehnii Ref.
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