input word = C00020490

Metabolite InformationStructural formula
Name Peroxyeupahakonin A
Formula C20H24O8
Mw 392.14711774
CAS RN 82425-23-8
C_ID C00020490 ,
InChIKey RKTXNXWAPMYGJZ-PCLJSMFHNA-N
InChICode InChI=1S/C20H24O8/c1-10-4-6-20(28-25)11(2)8-14(26-19(24)13(9-22)5-7-21)15-12(3)18(23)27-17(15)16(10)20/h4-5,8,14-17,21-22,25H,3,6-7,9H2,1-2H3/b13-5+/t14-,15-,16+,17-,20+/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)/C(=C/CO)CO)C=C(C)[C@]1(OO)CC=C(C)[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium chinense Ref.
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