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MYRSINIONOSIDE-A-TETRAACETATE
SpectraBase Compound ID 8Tip7ZjxSed
InChI InChI=1S/C27H42O11/c1-14-11-20(32)12-27(7,8)21(14)10-9-15(2)34-26-25(37-19(6)31)24(36-18(5)30)23(35-17(4)29)22(38-26)13-33-16(3)28/h14-15,21-26H,9-13H2,1-8H3/t14-,15+,21+,22+,23+,24-,25+,26+/m1/s1
InChIKey RSSIXGVMWOITFJ-PQBRSRJPSA-N
Mol Weight 542.6 g/mol
Molecular Formula C27H42O11
Exact Mass 542.272712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4h2dqmyC4vh
Name MYRSINIONOSIDE-A-TETRAACETATE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O11
InChI InChI=1S/C27H42O11/c1-14-11-20(32)12-27(7,8)21(14)10-9-15(2)34-26-25(37-19(6)31)24(36-18(5)30)23(35-17(4)29)22(38-26)13-33-16(3)28/h14-15,21-26H,9-13H2,1-8H3/t14-,15+,21+,22+,23+,24-,25+,26+/m1/s1
InChIKey RSSIXGVMWOITFJ-PQBRSRJPSA-N
Literature Reference Author H.OTSUKA,X.N.ZHONG,E.HIRATA,T.SHINZATO,Y.TAKEDA
Literature Reference Citation CHEM.PHARM.BULL.,49,1093(2001)
Literature Reference DOI 10.1248/cpb.49.1093
Molecular Weight 542.624 g/mol
Solvent CD3OD
Source File Reference UWVN29141