input word = C00049752

Metabolite InformationStructural formula
Name Tournefolin A
(-)-Tournefolin A
Formula C16H22O4
Mw 278.15180919
CAS RN 250643-36-8
C_ID C00049752 ,
InChIKey VWWSDOAXICNGRC-WNMXYPQANA-N
InChICode InChI=1S/C16H22O4/c1-9-3-15(19-7-9)11-5-14(18)12(6-13(11)17)16-4-10(2)8-20-16/h5-6,9-10,15-18H,3-4,7-8H2,1-2H3/t9-,10-,15-,16+/m1/s1
SMILES c1c(c(cc(c1O)[C@@H]1OC[C@@H](C1)C)O)[C@H]1OC[C@@H](C1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHeliotropiaceaeTournefortia sarmentosa Ref.
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