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11-EPI-EPHEDRADINE-A-N,N,O-TRIACETATE,11-EPI-ORANTINE-N,N,O-TRIACETATE
SpectraBase Compound ID HqdgK2WYukW
InChI InChI=1S/2C34H42N4O7/c2*1-22(39)36-15-4-5-16-37-17-6-14-35-31(42)21-29(38(23(2)40)19-7-18-36)26-10-13-30-28(20-26)32(34(37)43)33(45-30)25-8-11-27(12-9-25)44-24(3)41/h2*8-13,20,29,32-33H,4-7,14-19,21H2,1-3H3,(H,35,42)/t2*29-,32-,33+/m11/s1
InChIKey QBIAXQABRXOYPE-URQXTRDQSA-N
Mol Weight 1237.5 g/mol
Molecular Formula C68H84N8O14
Exact Mass 1236.610699 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LZIkY4wswOe
Name 11-EPI-EPHEDRADINE-A-N,N,O-TRIACETATE,11-EPI-ORANTINE-N,N,O-TRIACETATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H84N8O14
InChI InChI=1S/2C34H42N4O7/c2*1-22(39)36-15-4-5-16-37-17-6-14-35-31(42)21-29(38(23(2)40)19-7-18-36)26-10-13-30-28(20-26)32(34(37)43)33(45-30)25-8-11-27(12-9-25)44-24(3)41/h2*8-13,20,29,32-33H,4-7,14-19,21H2,1-3H3,(H,35,42)/t2*29-,32-,33+/m11/s1
InChIKey QBIAXQABRXOYPE-URQXTRDQSA-N
Literature Reference Author V.U.AHMAD,V.SULTANA
Literature Reference Citation J.NAT.PROD.,53,1162(1990)
Literature Reference DOI 10.1021/np50071a004
Molecular Weight 1237.460 g/mol
Solvent CDCl3
Source File Reference UWRU212