input word = C00020422

Metabolite InformationStructural formula
Name alpha-Kessyl alcohol
Formula C15H26O2
Mw 238.19328007
CAS RN 3321-65-1
C_ID C00020422 ,
InChIKey ZADVMZUKWWMSLQ-JEIHUYJWNA-N
InChICode InChI=1S/C15H26O2/c1-9-7-12(16)13-11(9)8-10-5-6-15(13,4)17-14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11-,12-,13+,15+/m1/s1
SMILES [C@H]12[C@@H]([C@@H](C[C@H]1C)O)[C@]1(OC([C@@H](C2)CC1)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
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