(3S,4R,5R,6S,7S)-1,8-Bis[(p-toluenesulfonyl)oxy]-4-(dibenzylamino)-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane

SpectraBase Compound ID	KQlzvwPblzN
InChI	InChI=1S/C41H51NO11S2/c1-30-16-20-34(21-17-30)54(44,45)50-25-24-36(43)38(42(26-32-12-8-6-9-13-32)27-33-14-10-7-11-15-33)40(49-29-48-5)39-37(52-41(3,4)53-39)28-51-55(46,47)35-22-18-31(2)19-23-35/h6-23,36-40,43H,24-29H2,1-5H3/t36-,37-,38+,39+,40+/m0/s1
InChIKey	TZABXXXNKQRENH-IAAQWQSGSA-N Google Search
Mol Weight	798.0 g/mol
Molecular Formula	C41H51NO11S2
Exact Mass	797.290354 g/mol

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SpectraBase Spectrum ID	CAj0TiImjHO
Name	(3S,4R,5R,6S,7S)-1,8-Bis[(p-toluenesulfonyl)oxy]-4-(dibenzylamino)-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C41H51NO11S2
InChI	InChI=1S/C41H51NO11S2/c1-30-16-20-34(21-17-30)54(44,45)50-25-24-36(43)38(42(26-32-12-8-6-9-13-32)27-33-14-10-7-11-15-33)40(49-29-48-5)39-37(52-41(3,4)53-39)28-51-55(46,47)35-22-18-31(2)19-23-35/h6-23,36-40,43H,24-29H2,1-5H3/t36-,37-,38+,39+,40+/m0/s1
InChIKey	TZABXXXNKQRENH-IAAQWQSGSA-N
Molecular Weight	797.975 g/mol
SMILES	O[C@]([C@@](N(Cc1ccccc1)Cc1ccccc1)([C@]([C@]1([C@](COS(c2ccc(cc2)C)(=O)=O)(OC(C)(C)O1)[H])[H])(OCOC)[H])[H])(CCOS(c1ccc(cc1)C)(=O)=O)[H]
SPLASH	splash10-0a4i-0930000000-dcb43cc70e75095c3afb
Source of Spectrum	J-58-60-30
Synonyms	(3S,4R,5R,6S,7S)-1,8-Bis[(p-toluenesulfonyl)oxy]-3-hydroxy-4-(dibenzylamino)-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane
Wiley ID	1417136