input word = C00021098

Metabolite InformationStructural formula
Name Gaillardilin
Formula C17H22O6
Mw 322.14163844
CAS RN 5257-99-8
C_ID C00021098 ,
InChIKey UBKAHVHWYYAPTL-LZGSEIDZNA-N
InChICode InChI=1S/C17H22O6/c1-6-5-9-10(7(2)16(20)22-9)14(21-8(3)18)17(4)11(6)12(19)13-15(17)23-13/h6,9-15,19H,2,5H2,1,3-4H3/t6-,9+,10-,11-,12+,13+,14-,15+,17-/m1/s1
SMILES [C@@H]12[C@]([C@@H]([C@H]3[C@H](C[C@H]1C)OC(=O)C3=C)OC(=O)C)([C@@H]1[C@H]([C@H]2O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGaillardia arizonica Ref.
PlantaeAsteraceaeGaillardia pinnatifida Ref.
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