input word = C00017445

Metabolite InformationStructural formula
Name Warburgin
Formula C16H16O4
Mw 272.104859
CAS RN 10208-62-5
C_ID C00017445 ,
InChIKey WMGPMCXBYLQVBP-RYEWIPQUNA-N
InChICode InChI=1S/C16H16O4/c1-9-13(17)5-4-10-6-14-11(7-16(9,10)2)12(8-20-14)15(18)19-3/h4-6,8-9H,7H2,1-3H3/t9-,16+/m0/s1
SMILES C1=CC2=Cc3c(C[C@@]2([C@H](C1=O)C)C)c(co3)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCanellaceaeWarburgia ugandensis Ref.
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