input word = C00012443

Metabolite InformationStructural formula
Name Humulene epoxide
Humulene oxide
alpha-Humulene oxide
Humulene I epoxide
Humulene epoxide I
Humulene monoxide
Humulene oxide I
Formula C15H24O
Mw 220.18271539
CAS RN 19888-33-6
C_ID C00012443 ,
InChIKey RKQDKXOBRXTSFS-OIIBJQEVNA-N
InChICode InChI=1S/C15H24O/c1-12-7-5-9-14(2,3)11-13-15(4,16-13)10-6-8-12/h5,8-9,13H,6-7,10-11H2,1-4H3/b9-5+,12-8+/t13-,15-/m1/s1
SMILES C\1=C(/C/C=C/C(C[C@H]2O[C@@]2(CC1)C)(C)C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeAnnonaceaeXylopia parviflora Ref.
PlantaeAsteraceaeMatricaria recutita Ref.
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeLabiataeMentha arvensis L. Ref.
PlantaeLabiataeOcimum basilicum Ref.
PlantaeLabiataeSalvia officinalis Ref.
PlantaeLauraceaeLitsea monopetala Ref.
PlantaeMyrtaceaeMyrtus communis Ref.
PlantaeMyrtaceaePsidium guajava Ref.
PlantaePolygonaceaePolygonum minus Ref.
PlantaeRutaceaeCitrus aurantifolia Ref.
PlantaeZingiberaceaeCurcuma xanthorrhiza Ref.
PlantaeZingiberaceaeZingiber zerumbet Ref.
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