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

SpectraBase Compound ID	1Rgr6NDTU9g
InChI	InChI=1S/C61H69NO15S/c1-5-6-7-8-9-21-34-68-46-30-32-47(33-31-46)78-61-57(72-37-45-26-17-12-18-27-45)56(71-36-44-24-15-11-16-25-44)53(70-35-43-22-13-10-14-23-43)50(77-61)39-73-60-52(62-58(66)48-28-19-20-29-49(48)59(62)67)55(75-42(4)65)54(74-41(3)64)51(76-60)38-69-40(2)63/h10-20,22-33,50-57,60-61H,5-9,21,34-39H2,1-4H3/t50-,51+,52+,53-,54+,55+,56+,57-,60+,61+/m1/s1
InChIKey	GNOZPXLXIREROT-QWEQFDDNSA-N Google Search
Mol Weight	1088.3 g/mol
Molecular Formula	C61H69NO15S
Exact Mass	1087.438792 g/mol

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SpectraBase Spectrum ID	JhlCCko5ZK
Name	PARA-OCTYLOXYPHENYL-3,4,6-TRI-O-ACETYL-2-N-PHTHALOYL-BETA-(1->6)-D-GLUCOSAMINYL-1-THIO-2,3,4-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSIDE
Compound Number	11A
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C61H69NO15S
InChI	InChI=1S/C61H69NO15S/c1-5-6-7-8-9-21-34-68-46-30-32-47(33-31-46)78-61-57(72-37-45-26-17-12-18-27-45)56(71-36-44-24-15-11-16-25-44)53(70-35-43-22-13-10-14-23-43)50(77-61)39-73-60-52(62-58(66)48-28-19-20-29-49(48)59(62)67)55(75-42(4)65)54(74-41(3)64)51(76-60)38-69-40(2)63/h10-20,22-33,50-57,60-61H,5-9,21,34-39H2,1-4H3/t50-,51+,52+,53-,54+,55+,56+,57-,60+,61+/m1/s1
InChIKey	GNOZPXLXIREROT-QWEQFDDNSA-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	1088.277 g/mol
Source File Reference	UWBT4084