Isotetrandrine N-2'-oxide

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0134
CAS
70191-83-2
Product Name
Isotetrandrine N-2'-oxide
Structure

Product Details

Description
Isotetrandrine N-2'-oxide is isolated from the roots of Stephania tetrandra S.Moore.
Synonyms
Isotetrandrine N2'-oxide
IUPAC Name
(1S,14R)-9,20,21,25-tetramethoxy-15,30-dimethyl-30-oxido-7,23-dioxa-15-aza-30-azoniaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaene
Molecular Weight
638.8
Molecular Formula
C38H42N2O7
Canonical SMILES
CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C4)OC)OC5=CC=C(CC6C7=CC(=C(C=C7CC[N+]6(C)[O-])OC)O3)C=C5)OC)OC
InChI
InChI=1S/C38H42N2O7/c1-39-15-13-26-21-35(44-5)37(45-6)38-36(26)29(39)17-24-9-12-31(42-3)33(19-24)46-27-10-7-23(8-11-27)18-30-28-22-34(47-38)32(43-4)20-25(28)14-16-40(30,2)41/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30+,40?/m1/s1
InChIKey
XOKSQIGOCSEXEF-HMRFYLJESA-N
Purity
95%
Appearance
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pKa
7.12±0.20(Predicted)
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