input word = C00053682

Metabolite InformationStructural formula
Name Phytol acetate
Formula C22H42O2
Mw 338.31848058
CAS RN 10236-16-5
C_ID C00053682
InChIKey JIGCTXHIECXYRJ-ILWBRPEASA-N
InChICode InChI=1S/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+/t19-,20-/m1/s1
SMILES CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC/C(C)=C/COC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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