input word = C00003401

Metabolite InformationStructural formula
Name Orobanchyl acetate
Alectrol
(+)-Orobanchyl acetate
Formula C21H24O7
Mw 388.15220312
CAS RN 143572-84-3
C_ID C00003401 ,
InChIKey FIKOOQXJBAJJSE-PJMQMMFENA-N
InChICode InChI=1S/C19H22O6/c1-10-7-14(24-16(10)20)23-9-13-12-8-11-5-4-6-18(2,3)19(11,22)15(12)25-17(13)21/h7-9,12,14-15,22H,4-6H2,1-3H3/b13-9+/t12-,14-,15+,19+/m1/s1
SMILES C1CCC2=C[C@H]3[C@@H]([C@@]2(C1(C)C)O)OC(=O)/C/3=C/O[C@H]1C=C(C(=O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeFabaceaeTrifolium pratense L. Ref.
PlantaeFabaceaeVigna unguiculata Ref.
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