input word = C00058393

Metabolite InformationStructural formula
Name Canelilline
Formula C18H21NO3
Mw 299.15214354
CAS RN 151757-04-9
C_ID C00058393
InChIKey SHWPEIHPZQIGDT-INIZCTEOSA-N
InChICode InChI=1S/C18H21NO3/c1-19-7-6-13-10-18(22-2)17(21)11-15(13)16(19)9-12-4-3-5-14(20)8-12/h3-5,8,10-11,16,20-21H,6-7,9H2,1-2H3/t16-/m0/s1
SMILES COc1cc2c(cc1O)[C@H](Cc1cccc(O)c1)N(C)CC2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeAniba canelilla Ref.
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