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(1S,4R,5S,6R,7S,10S,11R)-XANTHAN-12,6-OLIDE,5-ANGELOYLOXY-1,4-DIHYDROXY-2-OXO

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(1S,4R,5S,6R,7S,10S,11R)-XANTHAN-12,6-OLIDE,5-ANGELOYLOXY-1,4-DIHYDROXY-2-OXO
SpectraBase Compound ID 5IEfJZHlipP
InChI InChI=1S/C20H30O7/c1-6-10(2)18(23)27-17-16-14(13(5)19(24)26-16)8-7-11(3)20(17,25)15(22)9-12(4)21/h6,11-14,16-17,21,25H,7-9H2,1-5H3/b10-6-/t11-,12-,13+,14-,16+,17-,20+/m0/s1
InChIKey BBAISYCWVQINOR-QKKQDRQLSA-N
Mol Weight 382.45 g/mol
Molecular Formula C20H30O7
Exact Mass 382.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMRVg1nrSGW
Name (1S,4R,5S,6R,7S,10S,11R)-XANTHAN-12,6-OLIDE,5-ANGELOYLOXY-1,4-DIHYDROXY-2-OXO
Comments *** Assignment error - check entry manually
Compound Number 1582
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H30O7/c1-6-10(2)18(23)27-17-16-14(13(5)19(24)26-16)8-7-11(3)20(17,25)15(22)9-12(4)21/h6,11-14,16-17,21,25H,7-9H2,1-5H3/b10-6-/t11-,12-,13+,14-,16+,17-,20+/m0/s1
InChIKey BBAISYCWVQINOR-QKKQDRQLSA-N
Literature Reference NO.AUTHOR.AVAILABLE ANNUAL REPORTS,NMR,30
Solvent Chloroform