| SpectraBase Compound ID | 81baOfgjpnF |
|---|---|
| InChI | InChI=1S/C73H83N2O18P/c1-52(76)75-64-68(78-2)67-62(49-86-71(93-67)59-38-23-10-24-39-59)91-72(64)87-48-60(80-42-53-26-11-4-12-27-53)65(82-44-55-30-15-6-16-31-55)61(81-43-54-28-13-5-14-29-54)50-89-94(77,88-41-25-40-74)90-51-63-66(83-45-56-32-17-7-18-33-56)69(84-46-57-34-19-8-20-35-57)70(73(79-3)92-63)85-47-58-36-21-9-22-37-58/h4-24,26-39,60-73H,25,41-51H2,1-3H3,(H,75,76)/t60?,61?,62-,63+,64-,65?,66+,67+,68-,69-,70+,71+,72-,73+,94?/m0/s1 |
| InChIKey | TXXXLOFVVIFBSU-KWEZYKJESA-N |
| Mol Weight | 1307.4 g/mol |
| Molecular Formula | C73H83N2O18P |
| Exact Mass | 1306.537851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KIrPpuRFqqY |
|---|---|
| Name | (METHYL-2,3,4-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSID-6-YL)-2-CYANOETHYL-1-O-(2-ACETAMIDO-4,6-O-BENZYLIDENE-2-DEOXY-3-O-METHYL-BETA-D-GALACTOPYRANOSYL) |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C73H83N2O18P |
| InChI | InChI=1S/C73H83N2O18P/c1-52(76)75-64-68(78-2)67-62(49-86-71(93-67)59-38-23-10-24-39-59)91-72(64)87-48-60(80-42-53-26-11-4-12-27-53)65(82-44-55-30-15-6-16-31-55)61(81-43-54-28-13-5-14-29-54)50-89-94(77,88-41-25-40-74)90-51-63-66(83-45-56-32-17-7-18-33-56)69(84-46-57-34-19-8-20-35-57)70(73(79-3)92-63)85-47-58-36-21-9-22-37-58/h4-24,26-39,60-73H,25,41-51H2,1-3H3,(H,75,76)/t60?,61?,62-,63+,64-,65?,66+,67+,68-,69-,70+,71+,72-,73+,94?/m0/s1 |
| InChIKey | TXXXLOFVVIFBSU-KWEZYKJESA-N |
| Literature Reference Author | H.QIN,T.B.GRINDLEY |
| Literature Reference Citation | CAN.J.CHEM.,77,481(1999) |
| Literature Reference DOI | 10.1139/cjc-77-4-481 |
| Molecular Weight | 1307.438 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI5107 |