input word = C00036555

Metabolite InformationStructural formula
Name 3-Methoxytyramine BX
Formula C18H20N2O6
Mw 360.13213639
CAS RN 371157-07-2
C_ID C00036555 ,
InChIKey SBHOSQZNRDXQAX-JBACSLPBNA-N
InChICode InChI=1S/C18H20N2O6/c1-26-16-10-11(2-3-15(16)21)4-6-19-7-5-12-8-13(17(22)23)20-14(9-12)18(24)25/h2-3,5,7-8,10,14,20-21H,4,6,9H2,1H3,(H,22,23)(H,24,25)/b12-5-,19-7+/t14-/m0/s1
SMILES C\1(=C/C=N/CCc2ccc(c(c2)OC)O)/C[C@H](NC(=C1)C(=O)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeCelosia argentea var.cristata (L.) Kuntze Ref.
PlantaeAmaranthaceaeCelosia argentea var.plumosa (Burvenich) Voss Ref.
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