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(1R,3S,4S,5S,7R,9R,10R,11R)-1,7-DIHYDROXY-9-PARA-NITROBENZOYLOXYLONGIPINANE
SpectraBase Compound ID Cos020Y9AFD
InChI InChI=1S/C22H29NO6/c1-11-9-14(24)18-19-17(11)22(18,4)16(10-15(25)21(19,2)3)29-20(26)12-5-7-13(8-6-12)23(27)28/h5-8,11,14-19,24-25H,9-10H2,1-4H3/t11-,14+,15-,16-,17-,18+,19-,22+/m1/s1
InChIKey OADZXTJHAUXPOQ-RSJAGXMKSA-N
Mol Weight 403.48 g/mol
Molecular Formula C22H29NO6
Exact Mass 403.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HwYla0Bndal
Name (1R,3S,4S,5S,7R,9R,10R,11R)-1,7-DIHYDROXY-9-PARA-NITROBENZOYLOXYLONGIPINANE
Compound Number 36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO6
InChI InChI=1S/C22H29NO6/c1-11-9-14(24)18-19-17(11)22(18,4)16(10-15(25)21(19,2)3)29-20(26)12-5-7-13(8-6-12)23(27)28/h5-8,11,14-19,24-25H,9-10H2,1-4H3/t11-,14+,15-,16-,17-,18+,19-,22+/m1/s1
InChIKey OADZXTJHAUXPOQ-RSJAGXMKSA-N
Literature Reference Author M.MELENDEZ-RODRIGUEZ,C.M.CERDA-GARCIA-ROJAS,P.JOSEPH-NATHAN
Literature Reference Citation J.NAT.PROD.,65,1398(2002)
Literature Reference DOI 10.1021/np020158s
Molecular Weight 403.475 g/mol
Solvent CDCl3
Source File Reference UWBS1587