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MBXUNAIFBODHAL-KPDNTREXSA-N
SpectraBase Compound ID SbxY7ujNtf
InChI InChI=1S/2C28H38O14/c2*1-35-17-6-4-5-7-18(17)40-20(11-29)25(14-8-9-15(30)19(10-14)36-2)38-13-21-22(32)23(33)28(41-21)42-26-16(31)12-39-27(37-3)24(26)34/h2*4-10,16,20-34H,11-13H2,1-3H3/t16-,20+,21+,22+,23-,24-,25+,26+,27-,28+;16-,20-,21+,22+,23-,24-,25-,26+,27-,28+/m11/s1
InChIKey MBXUNAIFBODHAL-KPDNTREXSA-N
Mol Weight 1197.2 g/mol
Molecular Formula C56H76O28
Exact Mass 1196.452312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CkGJjIDxhT1
Name MBXUNAIFBODHAL-KPDNTREXSA-N
Compound Number 10,T
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H76O28
InChI InChI=1S/2C28H38O14/c2*1-35-17-6-4-5-7-18(17)40-20(11-29)25(14-8-9-15(30)19(10-14)36-2)38-13-21-22(32)23(33)28(41-21)42-26-16(31)12-39-27(37-3)24(26)34/h2*4-10,16,20-34H,11-13H2,1-3H3/t16-,20+,21+,22+,23-,24-,25+,26+,27-,28+;16-,20-,21+,22+,23-,24-,25-,26+,27-,28+/m11/s1
InChIKey MBXUNAIFBODHAL-KPDNTREXSA-N
Literature Reference Author M.TOIKKA,G.BRUNOW
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1877(1999)
Literature Reference DOI 10.1039/a900434c
Molecular Weight 1197.203 g/mol
Solvent ACETONE-D6
Source File Reference UWRU5620