| SpectraBase Compound ID | Ucn5DlaCJB |
|---|---|
| InChI | InChI=1S/C47H58O12/c1-46(2)55-30-35(57-46)38-40(59-47(3,4)58-38)37(49)36(48)39(51-26-31-18-10-6-11-19-31)43-41(52-27-32-20-12-7-13-21-32)42(53-28-33-22-14-8-15-23-33)44(45(50-5)56-43)54-29-34-24-16-9-17-25-34/h6-25,35-45,48-49H,26-30H2,1-5H3/t35-,36+,37-,38+,39-,40-,41+,42+,43?,44-,45+/m1/s1 |
| InChIKey | BLGXEHNJSPBGIN-WJMLPSMQSA-N |
| Mol Weight | 815.0 g/mol |
| Molecular Formula | C47H58O12 |
| Exact Mass | 814.392827 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5g8QSUsRjB5 |
|---|---|
| Name | METHYL-2,3,4,6-TETRA-O-BENZYL-9,10:11,12-DI-O-ISOPROPYLIDENE-D-ERYTHRO-L-MANNO-ALPHA-D-ERYTHRO-L-IDO-ALPHA-D-GLUCO-DODECA-1,5-PYRANOSIDE |
| Compound Number | 8B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H58O12 |
| InChI | InChI=1S/C47H58O12/c1-46(2)55-30-35(57-46)38-40(59-47(3,4)58-38)37(49)36(48)39(51-26-31-18-10-6-11-19-31)43-41(52-27-32-20-12-7-13-21-32)42(53-28-33-22-14-8-15-23-33)44(45(50-5)56-43)54-29-34-24-16-9-17-25-34/h6-25,35-45,48-49H,26-30H2,1-5H3/t35-,36+,37-,38+,39-,40-,41+,42+,43?,44-,45+/m1/s1 |
| InChIKey | BLGXEHNJSPBGIN-WJMLPSMQSA-N |
| Literature Reference Author | S.JAROSZ,M.MACH |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,3943(1998) |
| Literature Reference DOI | 10.1039/a807190j |
| Molecular Weight | 814.970 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP12158 |