| SpectraBase Compound ID | EGnIWbJWBAK |
|---|---|
| InChI | InChI=1S/C31H52O5/c1-20(2)21-12-17-29(7)24(27(21,5)15-14-25(32)35-9)11-10-22-23(13-16-28(22,29)6)30(8)18-19-31(34,36-30)26(3,4)33/h21-24,33-34H,1,10-19H2,2-9H3/t21?,22?,23-,24?,27-,28+,29+,30-,31?/m0/s1 |
| InChIKey | KAKRPQRRBBKOCQ-JHOGPLKJSA-N |
| Mol Weight | 504.8 g/mol |
| Molecular Formula | C31H52O5 |
| Exact Mass | 504.381475 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkwVxm8IZs4 |
|---|---|
| Name | AGLININ-A-METHYLESTER;MINOR-EPIMER |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O5 |
| InChI | InChI=1S/C31H52O5/c1-20(2)21-12-17-29(7)24(27(21,5)15-14-25(32)35-9)11-10-22-23(13-16-28(22,29)6)30(8)18-19-31(34,36-30)26(3,4)33/h21-24,33-34H,1,10-19H2,2-9H3/t21?,22?,23-,24?,27-,28+,29+,30-,31?/m0/s1 |
| InChIKey | KAKRPQRRBBKOCQ-JHOGPLKJSA-N |
| Literature Reference Author | K.MOHAMAD,T.SEVENET,V.DUMONTET,M.PAIS,M.V.TRI,H.HADI,K.AWANG ,M.T.MARTIN |
| Literature Reference Citation | PHYTOCHEM.,51,1031(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00053-9 |
| Molecular Weight | 504.751 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN11999 |