Metabolite

KNApSAcK Entry

id C00025571
Name Tetrandrine N-2'-oxide / Tetrandrine 2'beta-N-oxide / Tetrandrine mono-N-2'-oxide
CAS RN 62828-25-5
Standard InChI InChI=1S/C38H42N2O7/c1-39-14-12-26-21-35(44-5)37(45-6)38-36(26)29(39)17-24-10-11-31(42-3)33(19-24)46-27-9-7-8-23(16-27)18-30-28-22-34(47-38)32(43-4)20-25(28)13-15-40(30,2)41/h7-11,16,19-22,29-30H,12-15,17-18H2,1-6H3/t29-,30-,40+/m0/s1
Standard InChI (Main Layer) InChI=1S/C38H42N2O7/c1-39-14-12-26-21-35(44-5)37(45-6)38-36(26)29(39)17-24-10-11-31(42-3)33(19-24)46-27-9-7-8-23(16-27)18-30-28-22-34(47-38)32(43-4)20-25(28)13-15-40(30,2)41/h7-11,16,19-22,29-30H,12-15,17-18H2,1-6H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 10

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

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CTD

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