PCIDB

KNApSAcK Metabolite C00036555

Metabolite

KNApSAcK Entry

id C00036555
Name 3-Methoxytyramine BX
CAS RN 371157-07-2
Standard InChI 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
Standard InChI (Main Layer) 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)

Cluster

Phytochemical cluster No. 71
KCF-S cluster No. 1635

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN