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acetic acid [(1S,4aS,5S,6S,12bS)-9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]-1,4a,6,8,12b-pentahydroxy-7,12-diketo-3-methyl-1,4,5,6-tetrahydrobenzo[c]anthracen-5-yl] ester

Compound with spectra: 1 NMR

acetic acid [(1S,4aS,5S,6S,12bS)-9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]-1,4a,6,8,12b-pentahydroxy-7,12-diketo-3-methyl-1,4,5,6-tetrahydrobenzo[c]anthracen-5-yl] ester
SpectraBase Compound ID 69bY9CqytxX
InChI InChI=1S/C27H30O12/c1-9-6-16(30)27(37)19-18(24(35)25(39-11(3)28)26(27,36)8-9)23(34)17-13(22(19)33)5-4-12(21(17)32)15-7-14(29)20(31)10(2)38-15/h4-6,10,14-16,20,24-25,29-32,35-37H,7-8H2,1-3H3/t10-,14-,15-,16+,20-,24+,25+,26+,27-/m1/s1
InChIKey GQCCZNHIPKJGAM-WFGZNHFJSA-N
Mol Weight 546.53 g/mol
Molecular Formula C27H30O12
Exact Mass 546.173726 g/mol
Enantiomer InChIKey GQCCZNHIPKJGAM-SMZPZNSWSA-N

View Spectrum of acetic acid [(1S,4aS,5S,6S,12bS)-9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]-1,4a,6,8,12b-pentahydroxy-7,12-diketo-3-methyl-1,4,5,6-tetrahydrobenzo[c]anthracen-5-yl] ester

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Absolute Stereochemistry of Gastric Antisecretory Compound P371A1 and Its Congener P371A2 from Streptomyces Species P371 Journal of Natural Products 2000
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