input word = C00022411

Metabolite InformationStructural formula
Name 12xi-Hydroxy-7,13-labdadien-15,16-olide
Formula C20H30O3
Mw 318.21949482
CAS RN 88862-26-4
C_ID C00022411 ,
InChIKey UMEGZRBMAWYYCS-WWIWQPPSNA-N
InChICode InChI=1S/C20H30O3/c1-13-6-7-17-19(2,3)8-5-9-20(17,4)15(13)11-16(21)14-10-18(22)23-12-14/h6,10,15-17,21H,5,7-9,11-12H2,1-4H3/t15-,16+,17-,20-/m1/s1
SMILES CC1=CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1CC(O)C1=CC(=O)OC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcritopappus confertus Ref.
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