S-(4-AMINOBENZYL)-2,3,4,6-TETRA-O-BENZOYL-BETA-D-GALACTOPYRANOSYL-(1->4)-2,3,6-TRI-O-BENZOYL-1-THIO-BETA-D-GLUCOPYRANOSIDE

SpectraBase Compound ID	J2nk7BZP3Nj
InChI	InChI=1S/C68H57NO17S/c69-51-38-36-43(37-39-51)42-87-68-59(85-66(76)50-34-20-7-21-35-50)57(83-64(74)48-30-16-5-17-31-48)55(53(80-68)41-78-61(71)45-24-10-2-11-25-45)86-67-58(84-65(75)49-32-18-6-19-33-49)56(82-63(73)47-28-14-4-15-29-47)54(81-62(72)46-26-12-3-13-27-46)52(79-67)40-77-60(70)44-22-8-1-9-23-44/h1-39,52-59,67-68H,40-42,69H2/t52-,53-,54+,55-,56+,57+,58-,59-,67+,68+/m1/s1
InChIKey	UCZJLVKCDJGJDA-GSQRKOJDSA-N Google Search
Mol Weight	1192.3 g/mol
Molecular Formula	C68H57NO17S
Exact Mass	1191.334721 g/mol

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SpectraBase Spectrum ID	EfsztLOirao
Name	S-(4-AMINOBENZYL)-2,3,4,6-TETRA-O-BENZOYL-BETA-D-GALACTOPYRANOSYL-(1->4)-2,3,6-TRI-O-BENZOYL-1-THIO-BETA-D-GLUCOPYRANOSIDE
Compound Number	17
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C68H57NO17S
InChI	InChI=1S/C68H57NO17S/c69-51-38-36-43(37-39-51)42-87-68-59(85-66(76)50-34-20-7-21-35-50)57(83-64(74)48-30-16-5-17-31-48)55(53(80-68)41-78-61(71)45-24-10-2-11-25-45)86-67-58(84-65(75)49-32-18-6-19-33-49)56(82-63(73)47-28-14-4-15-29-47)54(81-62(72)46-26-12-3-13-27-46)52(79-67)40-77-60(70)44-22-8-1-9-23-44/h1-39,52-59,67-68H,40-42,69H2/t52-,53-,54+,55-,56+,57+,58-,59-,67+,68+/m1/s1
InChIKey	UCZJLVKCDJGJDA-GSQRKOJDSA-N
Literature Reference Author	D.I.ANGUS,M.J.KIEFEL,M.V.ITZSTEIN
Literature Reference Citation	BIOORG.MED.CHEM.,8,2709(2000)
Literature Reference DOI	10.1016/S0968-0896(00)00201-7
Molecular Weight	1192.257 g/mol
Solvent	CDCl3
Source File Reference	UWVN20489