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2,3,4-TRIACETOXY-7-DEOXY-TRANS-DIHYDRONARCIClASINE
SpectraBase Compound ID Fn7ypjovGkB
InChI InChI=1S/C20H21NO9/c1-8(22)28-16-5-12-11-4-14-15(27-7-26-14)6-13(11)20(25)21-17(12)19(30-10(3)24)18(16)29-9(2)23/h4,6,12,16-19H,5,7H2,1-3H3,(H,21,25)/t12-,16+,17-,18-,19+/m1/s1
InChIKey PFRIIIIZSBDKMP-QKPHTXKDSA-N
Mol Weight 419.39 g/mol
Molecular Formula C20H21NO9
Exact Mass 419.121631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fsw33MMojjk
Name 2,3,4-TRIACETOXY-7-DEOXY-TRANS-DIHYDRONARCICLASINE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21NO9
InChI InChI=1S/C20H21NO9/c1-8(22)28-16-5-12-11-4-14-15(27-7-26-14)6-13(11)20(25)21-17(12)19(30-10(3)24)18(16)29-9(2)23/h4,6,12,16-19H,5,7H2,1-3H3,(H,21,25)/t12-,16+,17-,18-,19+/m1/s1
InChIKey PFRIIIIZSBDKMP-QKPHTXKDSA-N
Literature Reference Author G.R.PETTIT,S.A.EASTHAM,N.MELODY,B.ORR,D.L.HERALD,J.MCGREGOR, J.C.KNIGHT,D.L.DOUBE
Literature Reference Citation J.NAT.PROD.,69,7(2006)
Literature Reference DOI 10.1021/np058068l
Molecular Weight 419.388 g/mol
Solvent CDCl3
Source File Reference UWMZ16441