input word = C00049754

Metabolite InformationStructural formula
Name Tournefolin C
Formula C12H10O5
Mw 234.05282343
CAS RN 250643-38-0
C_ID C00049754 ,
InChIKey NZODXKFWJHKDHQ-UHFFFAOYSA-N
InChICode InChI=1S/C12H10O5/c1-16-12(15)7-4-11(17-6-7)9-5-8(13)2-3-10(9)14/h2-6,13-14H,1H3
SMILES c1c(c(ccc1O)O)c1occ(c1)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHeliotropiaceaeTournefortia sarmentosa Ref.
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