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ALLYL-(3,4,6-TRI-O-ACETYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GALACTOPYRANOSYL)-(1->6)-[(2,3,4-TRI-O-PARA-TOLUOYL-BETA-D-GLUCOPYRANOSYL)-(1->3)]-4-O-ACET
SpectraBase Compound ID EWKG8KvQy3f
InChI InChI=1S/C69H68N2O25/c1-9-30-84-67-52(71-62(79)46-16-12-13-17-47(46)63(71)80)57(55(88-39(7)75)50(91-67)33-86-68-51(70-60(77)44-14-10-11-15-45(44)61(70)78)56(89-40(8)76)54(87-38(6)74)49(92-68)32-85-37(5)73)96-69-59(95-66(83)43-28-22-36(4)23-29-43)58(94-65(82)42-26-20-35(3)21-27-42)53(48(31-72)90-69)93-64(81)41-24-18-34(2)19-25-41/h9-29,48-59,67-69,72H,1,30-33H2,2-8H3/t48-,49+,50-,51+,52-,53-,54-,55+,56+,57-,58+,59-,67-,68+,69+/m0/s1
InChIKey CKOWGEWCJNMNEN-ZQSYJSTKSA-N
Mol Weight 1325.3 g/mol
Molecular Formula C69H68N2O25
Exact Mass 1324.411116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BbgAre99e7D
Name ALLYL-(3,4,6-TRI-O-ACETYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GALACTOPYRANOSYL)-(1->6)-[(2,3,4-TRI-O-PARA-TOLUOYL-BETA-D-GLUCOPYRANOSYL)-(1->3)]-4-O-ACET
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C69H68N2O25
InChI InChI=1S/C69H68N2O25/c1-9-30-84-67-52(71-62(79)46-16-12-13-17-47(46)63(71)80)57(55(88-39(7)75)50(91-67)33-86-68-51(70-60(77)44-14-10-11-15-45(44)61(70)78)56(89-40(8)76)54(87-38(6)74)49(92-68)32-85-37(5)73)96-69-59(95-66(83)43-28-22-36(4)23-29-43)58(94-65(82)42-26-20-35(3)21-27-42)53(48(31-72)90-69)93-64(81)41-24-18-34(2)19-25-41/h9-29,48-59,67-69,72H,1,30-33H2,2-8H3/t48-,49+,50-,51+,52-,53-,54-,55+,56+,57-,58+,59-,67-,68+,69+/m0/s1
InChIKey CKOWGEWCJNMNEN-ZQSYJSTKSA-N
Literature Reference Author K.M.HALKES,H.J.VERMEER,T.M.SLAGHEK,P.A.V.VANHOOFT,A.LOOF,J.P .KAMERLING,J.F.G.VLI
Literature Reference Citation CARBOHYDR.RES.,309,175(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00125-6
Molecular Weight 1325.297 g/mol
Solvent CDCl3
Source File Reference UWMP320