8-METHOXYCARBONYLOCTYL-5-N-ACETYL-ALPHA-NEURAMINYL-(2->3)-BETA-D-GALACTOPYRANOSYL-(1->3)-[ALPHA-L-FUCOPYRANOSYL-(1->4)]-2-DEOXY-2-(METHYL-BETA-D-

SpectraBase Compound ID	DiEcwEuMJaO
InChI	InChI=1S/C46H78N2O30/c1-17-26(56)29(59)33(63)43(71-17)74-35-22(16-51)73-41(70-12-10-8-6-5-7-9-11-23(55)68-3)25(48-40(65)39-31(61)30(60)32(62)42(69-4)76-39)37(35)75-44-34(64)38(28(58)21(15-50)72-44)78-46(45(66)67)13-19(53)24(47-18(2)52)36(77-46)27(57)20(54)14-49/h17,19-22,24-39,41-44,49-51,53-54,56-64H,5-16H2,1-4H3,(H,47,52)(H,48,65)(H,66,67)/t17-,19-,20+,21-,22-,24+,25-,26+,27+,28+,29+,30-,31+,32+,33-,34-,35-,36+,37-,38+,39-,41-,42+,43-,44+,46-/m0/s1
InChIKey	FVLYOHYXVLPPBB-NGKQAQTRSA-N Google Search
Mol Weight	1139.1 g/mol
Molecular Formula	C46H78N2O30
Exact Mass	1138.463939 g/mol

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SpectraBase Spectrum ID	DvryOdl6NEq
Name	8-METHOXYCARBONYLOCTYL-5-N-ACETYL-ALPHA-NEURAMINYL-(2->3)-BETA-D-GALACTOPYRANOSYL-(1->3)-[ALPHA-L-FUCOPYRANOSYL-(1->4)]-2-DEOXY-2-(METHYL-BETA-D-
Compound Number	10B
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C46H78N2O30
InChI	InChI=1S/C46H78N2O30/c1-17-26(56)29(59)33(63)43(71-17)74-35-22(16-51)73-41(70-12-10-8-6-5-7-9-11-23(55)68-3)25(48-40(65)39-31(61)30(60)32(62)42(69-4)76-39)37(35)75-44-34(64)38(28(58)21(15-50)72-44)78-46(45(66)67)13-19(53)24(47-18(2)52)36(77-46)27(57)20(54)14-49/h17,19-22,24-39,41-44,49-51,53-54,56-64H,5-16H2,1-4H3,(H,47,52)(H,48,65)(H,66,67)/t17-,19-,20+,21-,22-,24+,25-,26+,27+,28+,29+,30-,31+,32+,33-,34-,35-,36+,37-,38+,39-,41-,42+,43-,44+,46-/m0/s1
InChIKey	FVLYOHYXVLPPBB-NGKQAQTRSA-N
Literature Reference Author	G.BAISCH,R.OEHRLEIN
Literature Reference Citation	CARBOHYDR.RES.,312,61(1998)
Literature Reference DOI	10.1016/S0008-6215(98)00229-8
Molecular Weight	1139.121 g/mol
Solvent	CD3OD
Source File Reference	UWPA621