| SpectraBase Compound ID | I4HLqGA3PFF |
|---|---|
| InChI | InChI=1S/C28H40O10/c1-14(2)24(32)38-23-19(31)11-20-26(6,21-10-18-7-8-33-25(18)37-21)15(3)9-22(36-17(5)30)27(20,12-34-16(4)29)28(23)13-35-28/h7-8,14-15,18-23,25,31H,9-13H2,1-6H3/t15-,18+,19-,20-,21+,22+,23+,25-,26+,27+,28-/m1/s1 |
| InChIKey | MZEYOXXDMOFRMK-CBMKFDSUSA-N |
| Mol Weight | 536.6 g/mol |
| Molecular Formula | C28H40O10 |
| Exact Mass | 536.262147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6NKOdCMpCEc |
|---|---|
| Name | AJUGACHIN_A |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O10 |
| InChI | InChI=1S/C28H40O10/c1-14(2)24(32)38-23-19(31)11-20-26(6,21-10-18-7-8-33-25(18)37-21)15(3)9-22(36-17(5)30)27(20,12-34-16(4)29)28(23)13-35-28/h7-8,14-15,18-23,25,31H,9-13H2,1-6H3/t15-,18+,19-,20-,21+,22+,23+,25-,26+,27+,28-/m1/s1 |
| InChIKey | MZEYOXXDMOFRMK-CBMKFDSUSA-N |
| Literature Reference Author | I.M.BONEVA,B.P.MIKHOVA,P.Y.MALAKOV,G.Y.PAPANOV,H.DUDDECK,S.L .SPASSOV |
| Literature Reference Citation | PHYTOCHEM.,29,2931(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)87108-7 |
| Molecular Weight | 536.620 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ17726 |