input word = C00002175

Metabolite InformationStructural formula
Name Isofebrifugine
Formula C16H19N3O3
Mw 301.1426415
CAS RN 32434-44-9
C_ID C00002175 ,
InChIKey YLYLCQRQSRDSQR-LXVQFQBENA-N
InChICode InChI=1S/C16H19N3O3/c20-15-11-4-1-2-5-12(11)18-10-19(15)9-16(21)8-13-14(22-16)6-3-7-17-13/h1-2,4-5,10,13-14,17,21H,3,6-9H2/t13-,14+,16-/m0/s1
SMILES c1ccc2c(c1)c(=O)n(cn2)C[C@@]1(C[C@H]2[C@H](O1)CCCN2)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeHydrangeaceaeDichroa febrifuga Ref.
PlantaeHydrangeaceaeHydrangea macrophylla Ref.
PlantaeHydrangeaceaeHydrangea umbellata Ref.
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