input word = C00033577

Metabolite InformationStructural formula
Name 6-Angeloyljaeschkeanadiol
Jaeschkeanadiol 6-angelate
Formula C20H32O3
Mw 320.23514489
CAS RN 88721-11-3
C_ID C00033577 ,
InChIKey QNJGSTVOLOYKCR-KJUZECOJNA-N
InChICode InChI=1S/C20H32O3/c1-7-15(5)18(21)23-16-12-14(4)8-9-19(6)10-11-20(22,13(2)3)17(16)19/h7-8,13,16-17,22H,9-12H2,1-6H3/b15-7-/t16-,17+,19-,20+/m0/s1
SMILES C/C=C(/C)C(=O)O[C@H]1CC(C)=CC[C@@]2(C)CC[C@@](O)(C(C)C)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula elaeochytris Ref.
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OrganismFerula elaeochytris
ReferenceAlkhatib,Phytochem.,69,(2008),2979