| SpectraBase Compound ID | GQR0qZCFwOe |
|---|---|
| InChI | InChI=1S/C97H94N2O32/c1-11-44-115-94-72(98-84(105)64-16-12-13-17-65(64)85(98)106)78(130-96-82(128-92(113)62-40-28-53(6)29-41-62)80(126-90(111)60-36-24-51(4)25-37-60)74(68(45-100)120-96)124-88(109)58-32-20-49(2)21-33-58)77(119-57(10)104)71(122-94)48-117-95-73(99-86(107)66-18-14-15-19-67(66)87(99)108)79(76(118-56(9)103)70(123-95)47-116-55(8)102)131-97-83(129-93(114)63-42-30-54(7)31-43-63)81(127-91(112)61-38-26-52(5)27-39-61)75(69(46-101)121-97)125-89(110)59-34-22-50(3)23-35-59/h11-43,68-83,94-97,100-101H,1,44-48H2,2-10H3/t68-,69+,70+,71-,72-,73+,74-,75+,76-,77+,78-,79+,80+,81-,82-,83+,94-,95+,96+,97-/m1/s1 |
| InChIKey | YSSQVQKBNOTKOH-AQMGEGJFSA-N |
| Mol Weight | 1799.8 g/mol |
| Molecular Formula | C97H94N2O32 |
| Exact Mass | 1798.578969 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4eRfB0aI23Y |
|---|---|
| Name | ALLYL-(2,3,4-TRI-O-PARA-TOLUOYL-BETA-D-GLUCOPYRANOSYL)-(4,6-DI-O-ACETYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GALACTOPYRANOSYL)-[(2,3,4-TRI-O-PARA-TOLUOY |
| Compound Number | 28 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C97H94N2O32 |
| InChI | InChI=1S/C97H94N2O32/c1-11-44-115-94-72(98-84(105)64-16-12-13-17-65(64)85(98)106)78(130-96-82(128-92(113)62-40-28-53(6)29-41-62)80(126-90(111)60-36-24-51(4)25-37-60)74(68(45-100)120-96)124-88(109)58-32-20-49(2)21-33-58)77(119-57(10)104)71(122-94)48-117-95-73(99-86(107)66-18-14-15-19-67(66)87(99)108)79(76(118-56(9)103)70(123-95)47-116-55(8)102)131-97-83(129-93(114)63-42-30-54(7)31-43-63)81(127-91(112)61-38-26-52(5)27-39-61)75(69(46-101)121-97)125-89(110)59-34-22-50(3)23-35-59/h11-43,68-83,94-97,100-101H,1,44-48H2,2-10H3/t68-,69+,70+,71-,72-,73+,74-,75+,76-,77+,78-,79+,80+,81-,82-,83+,94-,95+,96+,97-/m1/s1 |
| InChIKey | YSSQVQKBNOTKOH-AQMGEGJFSA-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 | 1799.808 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMP306 |