input word = C00054120

Metabolite InformationStructural formula
Name Bufotenine O-glucoside
Formula C18H26N2O6
Mw 366.17908658
CAS RN 64656-15-1
C_ID C00054120
InChIKey GNUFCIHWKPAEBF-UYTYNIKBSA-N
InChICode InChI=1S/C18H26N2O6/c1-20(2)6-5-10-8-19-13-4-3-11(7-12(10)13)25-18-17(24)16(23)15(22)14(9-21)26-18/h3-4,7-8,14-19,21-24H,5-6,9H2,1-2H3/t14-,15-,16+,17-,18-/m1/s1
SMILES CN(C)CCc1c[nH]c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus unshiu Ref.
PlantaeRutaceaeZanthoxylum piperitum Ref.
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OrganismZanthoxylum piperitum
ReferenceAldrich Library of NMR Spectra, 2nd edn.,1983, 2, 530D (nmr)