| SpectraBase Compound ID | 5FFgVrLoTr2 |
|---|---|
| InChI | InChI=1S/C35H52O20/c1-6-14-13(2)19-7-15(14)17(30(44)48-5)11-49-32(54-34-28(42)26(40)24(38)20(9-36)52-34)23-16(8-22(46-3)47-4)18(31(45)51-19)12-50-33(23)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/b17-11-/t13-,14-,15-,16+,19-,20-,21+,23-,24-,25+,26+,27-,28-,29+,32+,33-,34+,35-/m0/s1 |
| InChIKey | MIRKZTSQOXLXQT-LNERKECOSA-N |
| Mol Weight | 792.8 g/mol |
| Molecular Formula | C35H52O20 |
| Exact Mass | 792.305194 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9QOFWH06Ry7 |
|---|---|
| Name | RAPULASIDE-B |
| Compound Number | 154 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H52O20 |
| InChI | InChI=1S/C35H52O20/c1-6-14-13(2)19-7-15(14)17(30(44)48-5)11-49-32(54-34-28(42)26(40)24(38)20(9-36)52-34)23-16(8-22(46-3)47-4)18(31(45)51-19)12-50-33(23)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/b17-11-/t13-,14-,15-,16+,19-,20-,21+,23-,24-,25+,26+,27-,28-,29+,32+,33-,34+,35-/m0/s1 |
| InChIKey | MIRKZTSQOXLXQT-LNERKECOSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,Y.HARIGAYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,689(2007) |
| Literature Reference DOI | 10.1248/cpb.55.689 |
| Molecular Weight | 792.786 g/mol |
| Sample ID | 37566 |
| Solvent | C5D5N |