| SpectraBase Compound ID | 7sGebceU1kK |
|---|---|
| InChI | InChI=1S/C33H50O15/c1-6-9-10-43-24(42-8-3)12-18-17(7-2)32(48-33-28(37)27(36)26(35)23(13-34)47-33)45-15-20(18)30(39)46-22-11-19-21(29(38)41-5)14-44-31(40)25(19)16(22)4/h7,14-19,22-28,31-37,40H,2,6,8-13H2,1,3-5H3/t16-,17+,18-,19+,22-,23-,24?,25+,26-,27+,28-,31+,32-,33+/m0/s1 |
| InChIKey | DLECRUMOKZRXPS-JMBZIIIDSA-N |
| Mol Weight | 686.7 g/mol |
| Molecular Formula | C33H50O15 |
| Exact Mass | 686.314971 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IAID2nIqr4X |
|---|---|
| Name | PTEROCESIDE-B;SYLVESTROSIDE-III-7-ETHYL-7-BUTYL-ACETAL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H50O15 |
| InChI | InChI=1S/C33H50O15/c1-6-9-10-43-24(42-8-3)12-18-17(7-2)32(48-33-28(37)27(36)26(35)23(13-34)47-33)45-15-20(18)30(39)46-22-11-19-21(29(38)41-5)14-44-31(40)25(19)16(22)4/h7,14-19,22-28,31-37,40H,2,6,8-13H2,1,3-5H3/t16-,17+,18-,19+,22-,23-,24?,25+,26-,27+,28-,31+,32-,33+/m0/s1 |
| InChIKey | DLECRUMOKZRXPS-JMBZIIIDSA-N |
| Literature Reference Author | Y.WU,Y.YIN,Y.LI,F.GUO,G.ZHU |
| Literature Reference Citation | MAGN.RES.CHEM.,52,734(2014) |
| Literature Reference DOI | 10.1002/mrc.4116 |
| Molecular Weight | 686.751 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT15821 |