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BROUSSONETINE-J;(2R)-2-[(1S,2S)-1,2-DIHYDROXY-8-[(2R,3R,4R,5R)-5-(2-HYDROXYMETHYL-3,4-DIHYDROXY-1-ACETYL-PYRROLIDINYL)]-OCTYL]-1-ACETYLPIPERIDINE

View entire compound with spectra: 2 NMR

BROUSSONETINE-J;(2R)-2-[(1S,2S)-1,2-DIHYDROXY-8-[(2R,3R,4R,5R)-5-(2-HYDROXYMETHYL-3,4-DIHYDROXY-1-ACETYL-PYRROLIDINYL)]-OCTYL]-1-ACETYLPIPERIDINE
SpectraBase Compound ID Bl0FiN4Dktl
InChI InChI=1S/C22H40N2O7/c1-14(26)23-12-8-7-9-16(23)20(29)19(28)11-6-4-3-5-10-17-21(30)22(31)18(13-25)24(17)15(2)27/h16-22,25,28-31H,3-13H2,1-2H3/t16-,17-,18-,19+,20+,21-,22-/m1/s1
InChIKey YIEPZDPKKNJALX-OWLUANBVSA-N
Mol Weight 444.6 g/mol
Molecular Formula C22H40N2O7
Exact Mass 444.283552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZEk6ZqgZFA
Name BROUSSONETINE-J;(2R)-2-[(1S,2S)-1,2-DIHYDROXY-8-[(2R,3R,4R,5R)-5-(2-HYDROXYMETHYL-3,4-DIHYDROXY-1-ACETYL-PYRROLIDINYL)]-OCTYL]-1-ACETYLPIPERIDINE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H40N2O7
InChI InChI=1S/C22H40N2O7/c1-14(26)23-12-8-7-9-16(23)20(29)19(28)11-6-4-3-5-10-17-21(30)22(31)18(13-25)24(17)15(2)27/h16-22,25,28-31H,3-13H2,1-2H3/t16-,17-,18-,19+,20+,21-,22-/m1/s1
InChIKey YIEPZDPKKNJALX-OWLUANBVSA-N
Literature Reference Author M.SHIBANO,S.NAKAMURA,M.KUBORI,K.MINOURA,G.KUSANO
Literature Reference Citation CHEM.PHARM.BULL.,46,1416(1998)
Literature Reference DOI 10.1248/cpb.46.1416
Molecular Weight 444.569 g/mol
Solvent C5D5N
Source File Reference UWMS20572