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6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24

Compound with spectra: 3 NMR, and 1 MS (GC)

6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24
SpectraBase Compound ID F6LONt5qexT
InChI InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18-/m0/s1
InChIKey IYGYMKDQCDOMRE-ROUUACIJSA-N
Mol Weight 367.36 g/mol
Molecular Formula C20H17NO6
Exact Mass 367.105587 g/mol
Enantiomer InChIKey IYGYMKDQCDOMRE-QZTJIDSGSA-N

View Spectrum of 6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24

15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of 6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24

15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

View Spectrum of 6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum X2-44-477-1

View Spectrum of 6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • Bicuculline
  • Adlumlidine
Bicuculline
Bicuculline
ISOHYDRASTIDINE
Isohydrastidin
(+/-)-ERYTHRO-1-[1'-(4',5'-DIMETHOXYPHTHALIDYL)]-2-METHYL-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
(+/-)-THREO-1-[1'-(4',5'-DIMETHOXYPHTHALIDYL)]-2-METHYL-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
Hydrastidin
HYDRASTIDINE
N-Carbethoxy-1,2-seco-1-chloronarcotine isomer
(-)-3-{[2-(N-Ethoxycarbonyl-N-methylaminoethyl)-6-methoxy-4,5-methylenedioxyphenyl]chloromethyl}-6,7-dimethoxy-1(3H)-isobenzofuranone
N-Carbethoxy-1,2-seco-1-chloronarcotine
Rheadan, 16-methyl-2,3:10,11-bis[methylenebis(oxy)]-
Title Journal or Book Year
Isoquinoline alkaloids: a15N NMR and x-ray study. Part 2 Magnetic Resonance in Chemistry 2002
Synthesis of Substituted (+)-Bicuculline Derivatives Through Chloromethylation Australian Journal of Chemistry 1990
Bicuculline
Bicuculline
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