input word = C00038866

Metabolite InformationStructural formula
Name Crotonadiol
(+)-Crotonadiol
Formula C20H34O2
Mw 306.25588033
CAS RN 117067-00-2
C_ID C00038866 ,
InChIKey QSQOTWULYOYGRR-XTCBRTQNNA-N
InChICode InChI=1S/C20H34O2/c1-14(9-12-21)7-8-16-15(2)13-17(22)18-19(3,4)10-6-11-20(16,18)5/h9,16-18,21-22H,2,6-8,10-13H2,1,3-5H3/b14-9+/t16-,17-,18-,20+/m0/s1
SMILES C=C1C[C@H](O)[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC/C(C)=C/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeCroton zambesicus Ref.
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