| SpectraBase Compound ID | 5RY4etmyku9 |
|---|---|
| InChI | InChI=1S/C29H38O17/c1-12(30)38-11-20-23(41-14(3)32)24(42-15(4)33)25(43-16(5)34)28(44-20)45-27-22-18(19(10-39-27)26(36)37-8)9-21(40-13(2)31)29(22,7)46-17(6)35/h10,18,20-25,27-28H,9,11H2,1-8H3/t18?,20-,21-,22?,23-,24+,25-,27-,28+,29-/m0/s1 |
| InChIKey | DIHJXNHWZMMDOD-XFTKPPONSA-N |
| Mol Weight | 658.6 g/mol |
| Molecular Formula | C29H38O17 |
| Exact Mass | 658.2109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 95SDsqQ6wMX |
|---|---|
| Name | CARYOPTOSIDE-HEXAACETATE |
| Compound Number | 2B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H38O17 |
| InChI | InChI=1S/C29H38O17/c1-12(30)38-11-20-23(41-14(3)32)24(42-15(4)33)25(43-16(5)34)28(44-20)45-27-22-18(19(10-39-27)26(36)37-8)9-21(40-13(2)31)29(22,7)46-17(6)35/h10,18,20-25,27-28H,9,11H2,1-8H3/t18?,20-,21-,22?,23-,24+,25-,27-,28+,29-/m0/s1 |
| InChIKey | DIHJXNHWZMMDOD-XFTKPPONSA-N |
| Literature Reference Author | S.DAMTOFT |
| Literature Reference Citation | PHYTOCHEM.,31,175(1992) |
| Literature Reference DOI | 10.1016/0031-9422(91)83030-O |
| Molecular Weight | 658.611 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU5216 |