input word = C00003168

Metabolite InformationStructural formula
Name Patchouli alcohol
Formula C15H26O
Mw 222.19836545
CAS RN 5986-55-0
C_ID C00003168 ,
InChIKey GGHMUJBZYLPWFD-YSJMOEHBNA-N
InChICode InChI=1S/C15H26O/c1-10-5-8-15(16)13(2,3)11-6-7-14(15,4)12(10)9-11/h10-12,16H,5-9H2,1-4H3/t10-,11+,12+,14-,15+/m0/s1
SMILES C[C@H]1CCC2(O)C(C)(C)C3CC[C@@]2(C)C1C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePogostemon cablin Ref.
PlantaeLabiataePogostemon patchouli Pellet. Ref.
PlantaeMagnoliaceaeMagnolia liliiflora Ref.
PlantaeRutaceaeMurraya paniculata Ref.
PlantaeValerianaceaeNardostachys chinensis Ref.
PlantaeValerianaceaeNardostachys jatamsi Ref.
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
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OrganismMagnolia liliiflora
Referencehttps://doi.org/10.1007/s13765-012-1162-1