(2R,4E)-N-[(2S,3S,4R)-1-(beta-D-Glucopyranosyloxy)-3,4-dihydroxytetracosan-2-yl]-2-hydroxyoctadec-4-enamide

SpectraBase Compound ID	95ObGDIgFQ9
InChI	InChI=1S/C48H93NO10/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-25-27-29-31-33-35-40(51)43(53)39(38-58-48-46(56)45(55)44(54)42(37-50)59-48)49-47(57)41(52)36-34-32-30-28-26-23-18-16-14-12-10-8-6-4-2/h32,34,39-46,48,50-56H,3-31,33,35-38H2,1-2H3,(H,49,57)/b34-32+/t39-,40+,41+,42+,43-,44+,45-,46+,48+/m0/s1
InChIKey	DDLYAWXBNYDUIN-QVWSJUNLSA-N Google Search
Mol Weight	844.3 g/mol
Molecular Formula	C48H93NO10
Exact Mass	843.679948 g/mol

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SpectraBase Spectrum ID	K8Naaw8yNpc
Name	(2R,4E)-N-[(2S,3S,4R)-1-(beta-D-Glucopyranosyloxy)-3,4-dihydroxytetracosan-2-yl]-2-hydroxyoctadec-4-enamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C48H93NO10
InChI	InChI=1S/C48H93NO10/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-25-27-29-31-33-35-40(51)43(53)39(38-58-48-46(56)45(55)44(54)42(37-50)59-48)49-47(57)41(52)36-34-32-30-28-26-23-18-16-14-12-10-8-6-4-2/h32,34,39-46,48,50-56H,3-31,33,35-38H2,1-2H3,(H,49,57)/b34-32+/t39-,40+,41+,42+,43-,44+,45-,46+,48+/m0/s1
InChIKey	DDLYAWXBNYDUIN-QVWSJUNLSA-N
Molecular Weight	844.269 g/mol
SMILES	N([C@]([C@@]([C@](O)(CCCCCCCCCCCCCCCCCCCC)[H])(O)[H])(CO[C@]1([C@](O)([C@@](O)([C@](O)([C@](O1)(CO)[H])[H])[H])[H])[H])[H])C([C@@](C\C=C\CCCCCCCCCCCCC)(O)[H])=O
SPLASH	splash10-001i-0007009000-c33dfd461a0838fc9a24
Source of Spectrum	H-93-2216-2
Synonyms	Pancovioside (R,E)-N-((2S,3S,4R)-3,4-dihydroxy-1-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetracosan-2-yl)-2-hydroxyoctadec-4-enamide
Wiley ID	1783915