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Tetrandrine
SpectraBase Compound ID 2a2Jr5LNzOz
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
InChIKey WVTKBKWTSCPRNU-UHFFFAOYSA-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 CvsNZbQknic
Name O,O-Dimethylkrukovine
CAS Registry Number 1263-79-2
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
InChIKey WVTKBKWTSCPRNU-UHFFFAOYSA-N
Molecular Weight 622.762 g/mol
SMILES COc1c2c3C(Cc4cc(c(OC)cc4)Oc4ccc(cc4)CC4c5cc(c(OC)cc5CCN4C)O2)N(C)CCc3cc1OC
SPLASH splash10-00di-0302009000-2a834f0350b02143b4e1
Source of Spectrum J-41-318-0
Synonyms (+)-Tetrandrine (-)-Phaeanthine (1.beta.)-6,6',7,12-Tetramethoxy-2,2'-dimethylberbaman 16H-1,24:6,9-dietheno-11,15-metheno-2H-pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinoline, 3,4,4a,5,16a,17,18,190octahydro-12,21,22,26-tetramethoxy-4,17-dimethyl-, (4aR,16aR)- 6,6',7,12-tetramethoxy-2,2'-dimethyl-9',10',11',12',13',14'-hexadehydro-9',10',11',12',13',14'-hexahydroberbaman 6,6',7,12-Tetramethoxy-2,2'-dimethylberbaman Berbaman, 6,6',7,12-tetramethoxy-2,2'-dimethyl-, (1'-beta)- Berbaman, 6,6',7,12-tetramethoxy-2,2'-dimethyl-, (1.beta.)- d-Tetrandrine Pheanthine R,R-tetrandrine Tetrandrin Tetrandrine NSC 105130 NSC 77037
Wiley ID 1411687