input word = C00020376

Metabolite InformationStructural formula
Name beta-Guaiene
Guaiene
Formula C15H24
Mw 204.18780077
CAS RN 88-84-6
C_ID C00020376 ,
InChIKey GIBQERSGRNPMEH-XXCBQWOANA-N
InChICode InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-12H,5-9H2,1-4H3/t11-,12-/m0/s1
SMILES C12=C(CC[C@@H]1C)[C@H](CCC(=C(C)C)C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
PlantaeAcoraceaeAcorus calamus Ref.
PlantaeAsteraceaeArtemisia annua Ref.
PlantaeLabiataeOcimum americanum Ref.
PlantaeLabiataeOcimum basilicum Ref.
PlantaeLabiataePogostemon cablin Ref.
PlantaePolygonaceaePolygonum minus Ref.
PlantaeRutaceaeAtalantia guillauminii Ref.
PlantaeZingiberaceaeCurcuma longa Ref.
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OrganismOcimum basilicum
ReferencePurushothaman, B. et al., J. Nat. Rem., 18, (2018), 71-85.