| SpectraBase Compound ID | BHbqEVAmphs |
|---|---|
| InChI | InChI=1S/C37H44O19/c1-16-26(44)12-24-25(35(45)48-14-29(46-8)23-9-10-27(50-18(3)39)28(11-23)51-19(4)40)13-49-36(31(16)24)56-37-34(54-22(7)43)33(53-21(6)42)32(52-20(5)41)30(55-37)15-47-17(2)38/h9-11,13,16,24,29-34,36-37H,12,14-15H2,1-8H3/t16-,24+,29?,30-,31+,32-,33+,34-,36-,37+/m0/s1 |
| InChIKey | OBPQABVCFNDOOC-UHPARHSPSA-N |
| Mol Weight | 792.7 g/mol |
| Molecular Formula | C37H44O19 |
| Exact Mass | 792.247679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 41pohzLtVYE |
|---|---|
| Name | SYRINGOPOCROSIDE_C_HEXAACETATE |
| Compound Number | 298 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H44O19 |
| InChI | InChI=1S/C37H44O19/c1-16-26(44)12-24-25(35(45)48-14-29(46-8)23-9-10-27(50-18(3)39)28(11-23)51-19(4)40)13-49-36(31(16)24)56-37-34(54-22(7)43)33(53-21(6)42)32(52-20(5)41)30(55-37)15-47-17(2)38/h9-11,13,16,24,29-34,36-37H,12,14-15H2,1-8H3/t16-,24+,29?,30-,31+,32-,33+,34-,36-,37+/m0/s1 |
| InChIKey | OBPQABVCFNDOOC-UHPARHSPSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 792.745 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ16259 |