input word = C00011885

Metabolite InformationStructural formula
Name Leucanthin A
Formula C23H26O10
Mw 462.15259705
CAS RN 58551-57-8
C_ID C00011885 ,
InChIKey OHHDXIRXYVPFMP-UKVSTXMXNA-N
InChICode InChI=1S/C23H26O10/c1-10-14-16(31-21(27)23(5)11(2)32-23)15(29-12(3)24)13(20(26)28-6)8-7-9-22(4)18(33-22)17(14)30-19(10)25/h7-9,11,14-18H,1H2,2-6H3/b9-7-,13-8+/t11-,14-,15+,16+,17+,18+,22-,23+/m1/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)C1(C)OC1C)[C@@H](OC(C)=O)/C(C(=O)OC)=CC=C/[C@@]1(C)O[C@@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium leucanthum Ref.
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