| SpectraBase Compound ID | LJLJDmc1v9q |
|---|---|
| InChI | InChI=1S/C31H46O11/c1-10-18(3)30(36)40-21(6)20(5)31(37)42-29-27(19(4)15-38-22(7)32)26(35)14-17(2)12-11-13-25(16-39-23(8)33)28(29)41-24(9)34/h10,12-13,19-21,26-29,35H,11,14-16H2,1-9H3/b17-12-,18-10+,25-13+ |
| InChIKey | SODBQKXNADUHHH-DZFDLWGFSA-N |
| Mol Weight | 594.7 g/mol |
| Molecular Formula | C31H46O11 |
| Exact Mass | 594.304012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IGye12jnNnm |
|---|---|
| Name | SODBQKXNADUHHH-DZFDLWGFSA-N |
| CAS Registry Number | 171367-52-5 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H46O11 |
| InChI | InChI=1S/C31H46O11/c1-10-18(3)30(36)40-21(6)20(5)31(37)42-29-27(19(4)15-38-22(7)32)26(35)14-17(2)12-11-13-25(16-39-23(8)33)28(29)41-24(9)34/h10,12-13,19-21,26-29,35H,11,14-16H2,1-9H3/b17-12-,18-10+,25-13+ |
| InChIKey | SODBQKXNADUHHH-DZFDLWGFSA-N |
| Literature Reference Author | J.LIU,J.ZAPP,H.BECKER |
| Literature Reference Citation | PLANTA.MED.,61,453(1995) |
| Literature Reference DOI | 10.1055/s-2006-958135 |
| Molecular Weight | 594.700 g/mol |
| Solvent | CD3OD |
| Source File Reference | UIAP735 |