input word = C00048311

Metabolite InformationStructural formula
Name alpha-Bergamotene
Formula C15H24
Mw 204.18780077
CAS RN 17699-05-7
C_ID C00048311 ,
InChIKey YMBFCQPIMVLNIU-UHFFFAOYNA-N
InChICode InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6-7,13-14H,5,8-10H2,1-4H3/t13-,14-,15-/m0/s1
SMILES [C@]1(CCC=C(C)C)(C)[C@H]2CC=C([C@@H]1C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeXylopia parviflora Ref.
PlantaeApiaceaeApium graveolens Ref.
PlantaeApiaceaeDaucus carota L. Ref.
PlantaeApiaceaeFoeniculum vulgare Ref.
PlantaeAraliaceaePanax ginseng Ref.
PlantaeAsteraceaeAgeratina conyzoides Ref.
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeLabiataeOcimum basilicum Ref.
PlantaeLabiataePerilla frutescens Ref.
PlantaeMalvaceaeGossypium hirsutum Ref.
PlantaePolygonaceaePolygonum minus Ref.
PlantaeRutaceaeAtalantia guillauminii Ref.
PlantaeRutaceaeCitrus aurantifolia Ref.
PlantaeRutaceaeCitrus bergamia Ref.
PlantaeRutaceaeCitrus hystrix Ref.
PlantaeRutaceaeCitrus limon Ref.
PlantaeRutaceaeCitrus medica Ref.
PlantaeRutaceaeMurraya paniculata Ref.
PlantaeSolanaceaeSolanum tuberosum Ref.
PlantaeZingiberaceaeCurcuma amada Ref.
PlantaeZingiberaceaeCurcuma amanda Roxb Ref.
PlantaeZingiberaceaeZingiber cassumunar Roxb. Ref.
PlantaeZingiberaceaeZingiber officinale Ref.
--Alphinia galanga Ref.
--Baeckea frutescens L. Ref.
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