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BIS-1,11-[2-ACETAMIDO-2-DEOXY-3-O-(BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSYL]-(6-TOSYL-3,9-DIOXA-6-AZA-UNDECANE)
SpectraBase Compound ID 5rrobRFSkjy
InChI InChI=1S/C43H71N3O26S/c1-20-4-6-23(7-5-20)73(61,62)46(8-10-63-12-14-65-40-28(44-21(2)51)38(32(55)26(18-49)67-40)71-42-36(59)34(57)30(53)24(16-47)69-42)9-11-64-13-15-66-41-29(45-22(3)52)39(33(56)27(19-50)68-41)72-43-37(60)35(58)31(54)25(17-48)70-43/h4-7,24-43,47-50,53-60H,8-19H2,1-3H3,(H,44,51)(H,45,52)/t24-,25+,26-,27+,28-,29?,30+,31-,32-,33?,34+,35-,36-,37+,38-,39+,40-,41+,42+,43-/m1/s1
InChIKey AVRODKDOCBVUOD-CPPLJGTOSA-N
Mol Weight 1078.1 g/mol
Molecular Formula C43H71N3O26S
Exact Mass 1077.404651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3aOc6Axppv
Name BIS-1,11-[2-ACETAMIDO-2-DEOXY-3-O-(BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSYL]-(6-TOSYL-3,9-DIOXA-6-AZA-UNDECANE)
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H71N3O26S
InChI InChI=1S/C43H71N3O26S/c1-20-4-6-23(7-5-20)73(61,62)46(8-10-63-12-14-65-40-28(44-21(2)51)38(32(55)26(18-49)67-40)71-42-36(59)34(57)30(53)24(16-47)69-42)9-11-64-13-15-66-41-29(45-22(3)52)39(33(56)27(19-50)68-41)72-43-37(60)35(58)31(54)25(17-48)70-43/h4-7,24-43,47-50,53-60H,8-19H2,1-3H3,(H,44,51)(H,45,52)/t24-,25+,26-,27+,28-,29?,30+,31-,32-,33?,34+,35-,36-,37+,38-,39+,40-,41+,42+,43-/m1/s1
InChIKey AVRODKDOCBVUOD-CPPLJGTOSA-N
Literature Reference Author R.G.LIO,J.THIEM
Literature Reference Citation CARBOHYDR.RES.,317,180(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00073-7
Molecular Weight 1078.101 g/mol
Solvent CDCl3
Source File Reference UWMZ4756