![#9;3-(BENZYLOXYCARBONYLAMINO)-1-PROPYL-6-O-(2-O-BENZOYL-3,4-DI-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-3-O-[(2-O-BENZOYL-3,4,6-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSYL)]-2-O](/api/spectrum/EGHSn6GVXL9/structure.png?h=300&w=458 "#9;3-(BENZYLOXYCARBONYLAMINO)-1-PROPYL-6-O-(2-O-BENZOYL-3,4-DI-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-3-O-[(2-O-BENZOYL-3,4,6-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSYL)]-2-O")
| SpectraBase Compound ID | 6ZMAeTTGka7 |
|---|---|
| InChI | InChI=1S/C85H87NO21/c87-49-67-71(95-51-59-31-12-2-13-32-59)74(97-53-61-35-16-4-17-36-61)77(105-80(90)65-43-24-8-25-44-65)83(101-67)99-57-68-70(88)73(76(104-79(89)64-41-22-7-23-42-64)82(102-68)94-48-28-47-86-85(92)100-55-63-39-20-6-21-40-63)107-84-78(106-81(91)66-45-26-9-27-46-66)75(98-54-62-37-18-5-19-38-62)72(96-52-60-33-14-3-15-34-60)69(103-84)56-93-50-58-29-10-1-11-30-58/h1-27,29-46,67-78,82-84,87-88H,28,47-57H2,(H,86,92)/t67-,68-,69-,70-,71-,72-,73+,74+,75+,76-,77-,78-,82-,83-,84+/m0/s1 |
| InChIKey | NGWGUHUGOMTGKQ-PCUKTFKISA-N |
| Mol Weight | 1458.6 g/mol |
| Molecular Formula | C85H87NO21 |
| Exact Mass | 1457.577059 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EGHSn6GVXL9 |
|---|---|
| Name | #9;3-(BENZYLOXYCARBONYLAMINO)-1-PROPYL-6-O-(2-O-BENZOYL-3,4-DI-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-3-O-[(2-O-BENZOYL-3,4,6-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSYL)]-2-O |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C85H87NO21 |
| InChI | InChI=1S/C85H87NO21/c87-49-67-71(95-51-59-31-12-2-13-32-59)74(97-53-61-35-16-4-17-36-61)77(105-80(90)65-43-24-8-25-44-65)83(101-67)99-57-68-70(88)73(76(104-79(89)64-41-22-7-23-42-64)82(102-68)94-48-28-47-86-85(92)100-55-63-39-20-6-21-40-63)107-84-78(106-81(91)66-45-26-9-27-46-66)75(98-54-62-37-18-5-19-38-62)72(96-52-60-33-14-3-15-34-60)69(103-84)56-93-50-58-29-10-1-11-30-58/h1-27,29-46,67-78,82-84,87-88H,28,47-57H2,(H,86,92)/t67-,68-,69-,70-,71-,72-,73+,74+,75+,76-,77-,78-,82-,83-,84+/m0/s1 |
| InChIKey | NGWGUHUGOMTGKQ-PCUKTFKISA-N |
| Literature Reference Author | R.GEURTSEN,F.COTE,M.G.HAHN,G.J.BOONS |
| Literature Reference Citation | J.ORG.CHEM.,64,7828(1999) |
| Literature Reference DOI | 10.1021/jo990836o |
| Molecular Weight | 1458.620 g/mol |
| Sample ID | 59962 |
| Solvent | CDCl3 |