input word = C00000804

Metabolite InformationStructural formula
Name (-)-3-Isothujone
(-)-alpha-Thujone
Thujone
alpha-Thujone
Formula C10H16O
Mw 152.12011513
CAS RN 546-80-5
C_ID C00000804 ,
InChIKey USMNOWBWPHYOEA-AFAAIUEZNA-N
InChICode InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1
SMILES C1(=O)C[C@@]2(C[C@@H]2[C@H]1C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiGanodermataceaeGanoderma lucidum Ref.
PlantaeAsteraceaeArtemisia absinthium Ref.
PlantaeAsteraceaeArtemisia annua Ref.
PlantaeAsteraceaeArtemisia herba-alba Ref.
PlantaeAsteraceaeChrysanthemum vulgare Ref.
PlantaeAsteraceaeTanacetum macrophyllum Ref.
PlantaeAsteraceaeTanacetum vulgare Ref.
PlantaeChenopodiaceaeChenopodium ambrosioides Ref.
PlantaeCupressaceaeJuniperus sabina Ref.
PlantaeCupressaceaeThuja occidentalis Ref.
PlantaeCupressaceaeThuja orientalis Ref.
PlantaeCupressaceaeThuja plicata Ref.
PlantaeLabiataeOcimum basilicum Ref.
PlantaeLabiataePerilla frutescens Ref.
PlantaeLabiataeSalvia officinalis Ref.
PlantaeLabiataeTetradenia riparia Ref.
PlantaeMyrtaceaePsidium guajava Ref.
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OrganismArtemisia absinthium
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter48