input word = C00033596

Metabolite InformationStructural formula
Name 8alpha-Tigloyloxydouglanin
Formula C20H26O5
Mw 346.17802394
CAS RN 481070-22-8
C_ID C00033596 ,
InChIKey WZWXPRLLGMOTNN-PAJMXSSUNA-N
InChICode InChI=1S/C20H26O5/c1-6-10(2)18(22)24-13-9-20(5)14(21)8-7-11(3)16(20)17-15(13)12(4)19(23)25-17/h6-7,13-17,21H,4,8-9H2,1-3,5H3/b10-6+/t13-,14-,15+,16+,17-,20-/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@@H](OC(=O)/C(C)=C/C)C[C@]1(C)[C@@H]2C(C)=CC[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAnthemis carpatica Ref.
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OrganismAnthemis carpatica
ReferenceStaneva,Phytochem.,69,(2008),607