| SpectraBase Compound ID | EZcGjKpY8jy |
|---|---|
| InChI | InChI=1S/C71H86N4O23/c1-40(2)89-69-62(98-70(81)71(4,5)6)57(87-38-45-30-20-12-21-31-45)59(61(97-69)64(80)83-8)95-67-50(74-75-72)55(85-36-43-26-16-10-17-27-43)52(47(34-76)90-67)93-68-51(78)56(86-37-44-28-18-11-19-29-44)58(60(96-68)63(79)82-7)94-66-49(73-41(3)77)54(84-35-42-24-14-9-15-25-42)53-48(91-66)39-88-65(92-53)46-32-22-13-23-33-46/h9-33,40,47-62,65-69,76,78H,34-39H2,1-8H3,(H,73,77)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57+,58+,59+,60-,61-,62-,65-,66-,67-,68-,69-/m1/s1 |
| InChIKey | DQZRMTISSWXEKU-VIFQVZAXSA-N |
| Mol Weight | 1363.5 g/mol |
| Molecular Formula | C71H86N4O23 |
| Exact Mass | 1362.568285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EXOvMMIqnMF |
|---|---|
| Name | #25;METHYL-[ISOPROPYL-O-(2-ACETAMIDO-3-O-BENZYL-4,6-O-BENZYLIDENE-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL-(1->4)-O-(METHYL-3-O-BENZYL-ALPHA-L-IDOPYRANOSYLURONATE-(1->4) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H86N4O23 |
| InChI | InChI=1S/C71H86N4O23/c1-40(2)89-69-62(98-70(81)71(4,5)6)57(87-38-45-30-20-12-21-31-45)59(61(97-69)64(80)83-8)95-67-50(74-75-72)55(85-36-43-26-16-10-17-27-43)52(47(34-76)90-67)93-68-51(78)56(86-37-44-28-18-11-19-29-44)58(60(96-68)63(79)82-7)94-66-49(73-41(3)77)54(84-35-42-24-14-9-15-25-42)53-48(91-66)39-88-65(92-53)46-32-22-13-23-33-46/h9-33,40,47-62,65-69,76,78H,34-39H2,1-8H3,(H,73,77)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57+,58+,59+,60-,61-,62-,65-,66-,67-,68-,69-/m1/s1 |
| InChIKey | DQZRMTISSWXEKU-VIFQVZAXSA-N |
| Literature Reference Author | R.OJEDA,J.ANGULO,P.M.NIETO,M.MARTIN-LOMAS |
| Literature Reference Citation | CAN.J.CHEM.,80,917(2002) |
| Literature Reference DOI | 10.1139/v02-023 |
| Molecular Weight | 1363.477 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU29955 |