input word = C00002681

Metabolite InformationStructural formula
Name Urushiol III
Formula C21H32O2
Mw 316.24023027
CAS RN 492-91-1
C_ID C00002681 ,
InChIKey RMTXUPIIESNLPW-KXKKYDSASA-N
InChICode InChI=1S/C21H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(22)21(19)23/h4-5,7-8,15,17-18,22-23H,2-3,6,9-14,16H2,1H3/b5-4-,8-7-
SMILES c1ccc(c(c1O)O)CCCCCCC/C=C/C/C=C\CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeToxicodendron radicans Ref.
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