input word = C00022182

Metabolite InformationStructural formula
Name 7alpha-Acetoxyhebemacrophyllide
Formula C22H30O5
Mw 374.20932407
CAS RN 111508-89-5
C_ID C00022182 ,
InChIKey CLDKIKGBGWQCOG-LZXOVEEKNA-N
InChICode InChI=1S/C22H30O5/c1-14(7-6-8-17-11-20(25)26-13-17)9-19(27-16(3)23)21-15(2)10-18(24)12-22(21,4)5/h7,10-11,19,21H,6,8-9,12-13H2,1-5H3/b14-7-/t19-,21+/m1/s1
SMILES CC(=O)O[C@H](C/C(C)=CCCC1=CC(=O)OC1)[C@@H]1C(C)=CC(=O)CC1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHebeclinium macrophyllum Ref.
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OrganismHebeclinium macrophyllum
ReferenceWarning,Phytochem.,26,(1987),2331