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(2S)-1-O-PALMITOYL-2-O-LINOLENOYL-3-O-[ALPHA-D-GALACTOPYRANOSYL-(1''->6')-(3''-O-LINOLEOYL)-BETA-D-GALACTOPYRANOSYL]-GLYCEROL
SpectraBase Compound ID 3SEZfzqoeWT
InChI InChI=1S/C67H116O16/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-58(70)80-54(51-77-57(69)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)52-78-66-63(75)62(74)60(72)56(82-66)53-79-67-64(76)65(61(73)55(50-68)81-67)83-59(71)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-28,54-56,60-68,72-76H,4-6,8-9,11-15,18,21-24,29-53H2,1-3H3/b10-7-,19-16-,20-17-,27-25-,28-26-/t54-,55+,56-,60+,61-,62+,63-,64+,65-,66-,67+/m1/s1
InChIKey JEVGMQRQCIITLN-YGQMESHZSA-N
Mol Weight 1177.6 g/mol
Molecular Formula C67H116O16
Exact Mass 1176.826338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1dCFUbEJxbe
Name (2S)-1-O-PALMITOYL-2-O-LINOLENOYL-3-O-[ALPHA-D-GALACTOPYRANOSYL-(1''->6')-(3''-O-LINOLEOYL)-BETA-D-GALACTOPYRANOSYL]-GLYCEROL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C67H116O16
InChI InChI=1S/C67H116O16/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-58(70)80-54(51-77-57(69)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)52-78-66-63(75)62(74)60(72)56(82-66)53-79-67-64(76)65(61(73)55(50-68)81-67)83-59(71)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-28,54-56,60-68,72-76H,4-6,8-9,11-15,18,21-24,29-53H2,1-3H3/b10-7-,19-16-,20-17-,27-25-,28-26-/t54-,55+,56-,60+,61-,62+,63-,64+,65-,66-,67+/m1/s1
InChIKey JEVGMQRQCIITLN-YGQMESHZSA-N
Literature Reference Author Z.GAO,Z.ALI,I.A.KHAN
Literature Reference Citation PHYTOCHEM.,69,2856(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.09.002
Molecular Weight 1177.648 g/mol
Sample ID 63794
Solvent C5D5N