input word = C00002160

Metabolite InformationStructural formula
Name Febrifugine
Formula C16H19N3O3
Mw 301.1426415
CAS RN 24159-07-7
C_ID C00002160 ,
InChIKey FWVHWDSCPKXMDB-PVRQQBJHNA-N
InChICode InChI=1S/C16H19N3O3/c20-11(8-14-15(21)6-3-7-17-14)9-19-10-18-13-5-2-1-4-12(13)16(19)22/h1-2,4-5,10,14-15,17,21H,3,6-9H2/t14-,15+/m0/s1
SMILES c1ccc2c(c1)c(=O)n(cn2)CC(=O)C[C@@H]1NCCC[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro Anthranilate
Organism
Kingdom Family Species Reference
PlantaeHydrangeaceaeDichroa febrifuga Ref.
PlantaeHydrangeaceaeHydrangea spp. Ref.
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