| SpectraBase Compound ID | Bsi4qfVRVEL |
|---|---|
| InChI | InChI=1S/C33H36O16/c1-18(34)41-15-24-25(44-19(2)35)26(45-20(3)36)27(31(47-24)49-30(39)23-13-9-6-10-14-23)48-32-28(46-21(4)37)33(40,17-43-32)16-42-29(38)22-11-7-5-8-12-22/h5-14,24-28,31-32,40H,15-17H2,1-4H3/t24-,25+,26-,27-,28-,31+,32-,33+/m0/s1 |
| InChIKey | MEQXTUWATSYCAH-XICOFNIHSA-N |
| Mol Weight | 688.6 g/mol |
| Molecular Formula | C33H36O16 |
| Exact Mass | 688.200335 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5CRtw498Li8 |
|---|---|
| Name | 3,4,6,2'-TETRAACETYL-2-O-BETA-D-APIOSYL-D-GLUCOSE-1-BETA,5'-DIBENZOATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H36O16 |
| InChI | InChI=1S/C33H36O16/c1-18(34)41-15-24-25(44-19(2)35)26(45-20(3)36)27(31(47-24)49-30(39)23-13-9-6-10-14-23)48-32-28(46-21(4)37)33(40,17-43-32)16-42-29(38)22-11-7-5-8-12-22/h5-14,24-28,31-32,40H,15-17H2,1-4H3/t24-,25+,26-,27-,28-,31+,32-,33+/m0/s1 |
| InChIKey | MEQXTUWATSYCAH-XICOFNIHSA-N |
| Literature Reference Author | B.F.BOWDEN,D.J.COLLINS |
| Literature Reference Citation | J.NAT.PROD.,51,311(1988) |
| Literature Reference DOI | 10.1021/np50056a020 |
| Molecular Weight | 688.639 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17460 |