input word = C00020954

Metabolite InformationStructural formula
Name Akihalin
Formula C15H20O5
Mw 280.13107375
CAS RN 65128-07-6
C_ID C00020954 ,
InChIKey VJXOJXBYJRLXQZ-UHFFFAOYNA-N
InChICode InChI=1S/C15H20O5/c1-7-8-6-10-9(4-5-14(10,2)18)15(3,19)12(16)11(8)20-13(7)17/h4,8,10-12,16,18-19H,1,5-6H2,2-3H3/t8-,10+,11+,12-,14+,15-/m0/s1
SMILES C12=CC[C@@]([C@@H]1C[C@@H]1[C@H]([C@@H]([C@@]2(C)O)O)OC(=O)C1=C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelenium autumnale Ref.
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