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DI-[(6-O-OLEOYL-BETA-D-GLUCOPYRANOSYL)-OXY]-ASTAXANTHIN
SpectraBase Compound ID FhkiI4b8sxs
InChI InChI=1S/C88H136O16/c1-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-53-75(89)99-61-73-79(93)81(95)83(97)85(103-73)101-71-59-87(9,10)69(67(7)77(71)91)57-55-65(5)51-45-49-63(3)47-43-44-48-64(4)50-46-52-66(6)56-58-70-68(8)78(92)72(60-88(70,11)12)102-86-84(98)82(96)80(94)74(104-86)62-100-76(90)54-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-2/h27-30,43-52,55-58,71-74,79-86,93-98H,13-26,31-42,53-54,59-62H2,1-12H3/b29-27-,30-28-,44-43+,49-45+,50-46+,57-55+,58-56+,63-47+,64-48+,65-51+,66-52+/t71-,72-,73+,74+,79+,80+,81-,82-,83+,84+,85+,86+/m0/s1
InChIKey PRVBBXXPCSWIMJ-PPEUYHTBSA-N
Mol Weight 1450.0 g/mol
Molecular Formula C88H136O16
Exact Mass 1448.982838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID n7oBuvUuhg
Name DI-[(6-O-OLEOYL-BETA-D-GLUCOPYRANOSYL)-OXY]-ASTAXANTHIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C88H136O16
InChI InChI=1S/C88H136O16/c1-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-53-75(89)99-61-73-79(93)81(95)83(97)85(103-73)101-71-59-87(9,10)69(67(7)77(71)91)57-55-65(5)51-45-49-63(3)47-43-44-48-64(4)50-46-52-66(6)56-58-70-68(8)78(92)72(60-88(70,11)12)102-86-84(98)82(96)80(94)74(104-86)62-100-76(90)54-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-2/h27-30,43-52,55-58,71-74,79-86,93-98H,13-26,31-42,53-54,59-62H2,1-12H3/b29-27-,30-28-,44-43+,49-45+,50-46+,57-55+,58-56+,63-47+,64-48+,65-51+,66-52+/t71-,72-,73+,74+,79+,80+,81-,82-,83+,84+,85+,86+/m0/s1
InChIKey PRVBBXXPCSWIMJ-PPEUYHTBSA-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 1450.038 g/mol
Sample ID 44750
Solvent CD3OD