PARA-OCTYLOXYPHENYL-3,4,6-TRI-O-ACETYL-2-N-PHTHALOYL-BETA-(1->6)-D-GLUCOSAMINYL-1-THIO-2,3,4-TRI-O-BENZOYL-BETA-D-GLUCOPYRANOSIDE

SpectraBase Compound ID	F8RjbUxtedb
InChI	InChI=1S/C61H63NO18S/c1-5-6-7-8-9-21-34-71-43-30-32-44(33-31-43)81-61-54(80-59(70)42-26-17-12-18-27-42)53(79-58(69)41-24-15-11-16-25-41)51(78-57(68)40-22-13-10-14-23-40)48(77-61)36-73-60-49(62-55(66)45-28-19-20-29-46(45)56(62)67)52(75-39(4)65)50(74-38(3)64)47(76-60)35-72-37(2)63/h10-20,22-33,47-54,60-61H,5-9,21,34-36H2,1-4H3/t47-,48+,49-,50-,51+,52-,53-,54+,60-,61-/m0/s1
InChIKey	OMLDCOLOTJJZMK-BZXLCWSWSA-N Google Search
Mol Weight	1130.2 g/mol
Molecular Formula	C61H63NO18S
Exact Mass	1129.376585 g/mol

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SpectraBase Spectrum ID	J2o8nj5d4lR
Name	PARA-OCTYLOXYPHENYL-3,4,6-TRI-O-ACETYL-2-N-PHTHALOYL-BETA-(1->6)-D-GLUCOSAMINYL-1-THIO-2,3,4-TRI-O-BENZOYL-BETA-D-GLUCOPYRANOSIDE
Compound Number	11B
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C61H63NO18S
InChI	InChI=1S/C61H63NO18S/c1-5-6-7-8-9-21-34-71-43-30-32-44(33-31-43)81-61-54(80-59(70)42-26-17-12-18-27-42)53(79-58(69)41-24-15-11-16-25-41)51(78-57(68)40-22-13-10-14-23-40)48(77-61)36-73-60-49(62-55(66)45-28-19-20-29-46(45)56(62)67)52(75-39(4)65)50(74-38(3)64)47(76-60)35-72-37(2)63/h10-20,22-33,47-54,60-61H,5-9,21,34-36H2,1-4H3/t47-,48+,49-,50-,51+,52-,53-,54+,60-,61-/m0/s1
InChIKey	OMLDCOLOTJJZMK-BZXLCWSWSA-N
Literature Reference Author	T.KAJIMOTO,K.ARMITSU,M.OZEKI,M.NODE
Literature Reference Citation	CHEM.PHARM.BULL.,58,758(2010)
Literature Reference DOI	10.1248/cpb.58.758
Molecular Weight	1130.227 g/mol
Source File Reference	UWBT4085