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(+)-TETRANDRINE-2'-BETA-N-OXIDE
SpectraBase Compound ID GHdAWllBhuw
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-FXMWOOKOSA-N
Mol Weight 638.8 g/mol
Molecular Formula C38H42N2O7
Exact Mass 638.299202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MfIPSgzVua
Name Tetrandrine - 2'-.beta.-N-Oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H42N2O7
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-FXMWOOKOSA-N
Molecular Weight 638.761 g/mol
SMILES c12c3C(N(C)CCc3cc(c1OC)OC)Cc1cc(Oc3ccc(CC4[N@@+]([O-])(C)CCc5cc(c(O2)cc45)OC)cc3)c(cc1)OC
SPLASH splash10-00di-0102009000-4ba2b141b020337b0f2c
Source of Spectrum X2-56-1992-3
Wiley ID 1605218