input word = C00020876

Metabolite InformationStructural formula
Name Ajafin
Formula C16H20O6
Mw 308.12598837
CAS RN 86925-82-8
C_ID C00020876 ,
InChIKey GAMKIMZLPVTBDV-UHFFFAOYNA-N
InChICode InChI=1S/C16H20O6/c1-6-5-8(17)10-7(2)15(20)22-13(10)11-9(6)12(18)14(19)16(11,3)21-4/h8,10-13,17-18H,2,5H2,1,3-4H3/t8-,10-,11-,12-,13-,16-/m1/s1
SMILES C12=C(C[C@H]([C@@H]3[C@H]([C@@H]1[C@@](C(=O)[C@@H]2O)(C)OC)OC(=O)C3=C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAjania fastigiata Ref.
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