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MORUSIMIC-ACID-A;(3R)-3-HYDROXY-12-[(1S,4S)-4-[(1S)-1-HYDROXYMETHYL]-PYRROLIDIN-1-YL]-DODECANOIC-ACID-3-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID EGuf41rgKWc
InChI InChI=1S/C24H45NO9/c1-15(27)18-12-11-16(25-18)9-7-5-3-2-4-6-8-10-17(13-20(28)29)33-24-23(32)22(31)21(30)19(14-26)34-24/h15-19,21-27,30-32H,2-14H2,1H3,(H,28,29)/t15-,16-,17+,18-,19-,21-,22+,23-,24-/m0/s1
InChIKey FRFNBNWFTRGFNL-QOQYUTECSA-N
Mol Weight 491.6 g/mol
Molecular Formula C24H45NO9
Exact Mass 491.309432 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1tulxMBnVO5
Name MORUSIMIC-ACID-A;(3R)-3-HYDROXY-12-[(1S,4S)-4-[(1S)-1-HYDROXYMETHYL]-PYRROLIDIN-1-YL]-DODECANOIC-ACID-3-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H45NO9
InChI InChI=1S/C24H45NO9/c1-15(27)18-12-11-16(25-18)9-7-5-3-2-4-6-8-10-17(13-20(28)29)33-24-23(32)22(31)21(30)19(14-26)34-24/h15-19,21-27,30-32H,2-14H2,1H3,(H,28,29)/t15-,16-,17+,18-,19-,21-,22+,23-,24-/m0/s1
InChIKey FRFNBNWFTRGFNL-QOQYUTECSA-N
Literature Reference Author G.KUSANO,S.ORIHARA,D.TSUKAMOTO,M.SHIBANO,M.COSKUN,A.GUVENC,C .S.ERDURAK
Literature Reference Citation CHEM.PHARM.BULL.,50,185(2002)
Literature Reference DOI 10.1248/cpb.50.185
Molecular Weight 491.623 g/mol
Solvent CD3OD
Source File Reference UWVN7860