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Tetrandrine
SpectraBase Compound ID JT9ZZH7Uoh6
InChI InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1
InChIKey WVTKBKWTSCPRNU-KYJUHHDHSA-N
Mol Weight 622.8 g/mol
Molecular Formula C38H42N2O6
Exact Mass 622.304287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MIc1NMWvox
Name Isotetrandrine
Alternate Name(s) (1beta)-6,6',7,12-tetramethoxy-2,2'-dimethylberbaman
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H42N2O6
InChI InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1
InChIKey WVTKBKWTSCPRNU-KYJUHHDHSA-N
Molecular Weight 622.762 g/mol
SMILES c12c3[C@@](N(C)CCc3cc(c1OC)OC)(Cc1cc(Oc3ccc(C[C@]4(c5cc(O2)c(cc5CCN4C)OC)[H])cc3)c(cc1)OC)[H]
SPLASH splash10-009w-9502003000-3a3fca79dcf90d7ea7cc
Source of Spectrum CD-142-0-0
Wiley ID 1411684