input word = C00011771

Metabolite InformationStructural formula
Name (-)-Ursanthemolide
Ursanthemolide
Formula C22H30O8
Mw 422.19406794
CAS RN 95653-76-2
C_ID C00011771 ,
InChIKey BBZQRHIYUIVXFF-CFEFBZLLNA-N
InChICode InChI=1S/C22H30O8/c1-11-7-8-16(24)12(2)10-18(19-13(3)20(25)29-17(19)9-11)30-21(26)22(6,27)14(4)28-15(5)23/h9,14,16-19,24,27H,2-3,7-8,10H2,1,4-6H3/b11-9+/t14-,16+,17-,18-,19+,22+/m1/s1
SMILES O[C@H]1CC/C(=C/[C@@H]2[C@@H]([C@@H](CC1=C)OC(=O)[C@@](C)(O)[C@@H](C)OC(=O)C)C(=C)C(=O)O2)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeUrsinia anthemoides Ref.
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