input word = C00012471

Metabolite InformationStructural formula
Name (+)-9-epi-beta-Caryophyllene
9-epi-(E)-Caryophyllene
Formula C15H24
Mw 204.18780077
CAS RN 68832-35-9
C_ID C00012471 ,
InChIKey NPNUFJAVOOONJE-FNVJYKNJNA-N
InChICode InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-/t13-,14+/m0/s1
SMILES C1(=C)CC/C=C(\CC[C@@H]2[C@H]1CC2(C)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeApiaceaeApium graveolens Ref.
PlantaeAraliaceaePanax ginseng Ref.
PlantaeAsteraceaeArtemisia annua Ref.
PlantaeMyrtaceaePsidium guajava Ref.
PlantaePinaceaePinus sibirica Ref.
PlantaePodocarpaceaeDacrydium cupressinum Ref.
PlantaeRutaceaeCitrus sinki x Poncirus trifoliata Ref.
PlantaeRutaceaeMurraya paniculata Ref.
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
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