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BIS-[(BETA-D-GLUCOPYRANOSYL)-OXY]-ASTAXANTHIN
SpectraBase Compound ID K1s9iTvM02z
InChI InChI=1S/C52H72O14/c1-29(17-13-19-31(3)21-23-35-33(5)41(55)37(25-51(35,7)8)63-49-47(61)45(59)43(57)39(27-53)65-49)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)42(56)38(26-52(36,9)10)64-50-48(62)46(60)44(58)40(28-54)66-50/h11-24,37-40,43-50,53-54,57-62H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t37-,38-,39+,40+,43+,44+,45-,46-,47+,48+,49+,50+/m0/s1
InChIKey OGSBMKNVQQESGO-NYBDDSGTSA-N
Mol Weight 921.1 g/mol
Molecular Formula C52H72O14
Exact Mass 920.492207 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 801pYhjwFm5
Name BIS-[(BETA-D-GLUCOPYRANOSYL)-OXY]-ASTAXANTHIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H72O14
InChI InChI=1S/C52H72O14/c1-29(17-13-19-31(3)21-23-35-33(5)41(55)37(25-51(35,7)8)63-49-47(61)45(59)43(57)39(27-53)65-49)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)42(56)38(26-52(36,9)10)64-50-48(62)46(60)44(58)40(28-54)66-50/h11-24,37-40,43-50,53-54,57-62H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t37-,38-,39+,40+,43+,44+,45-,46-,47+,48+,49+,50+/m0/s1
InChIKey OGSBMKNVQQESGO-NYBDDSGTSA-N
Literature Reference Author T.REZANKA,L.NEDBALOVA,K.SIGLER,V.CEPAK
Literature Reference Citation PHYTOCHEM.,69,479(2008)
Literature Reference DOI 10.1016/j.phytochem.2007.06.025
Molecular Weight 921.135 g/mol
Sample ID 44749
Solvent CD3OD