| SpectraBase Compound ID | IftIQtIdaKe |
|---|---|
| InChI | InChI=1S/C24H30O13/c1-3-12-13(6-7-34-22(32)14-8-11(26)4-5-16(14)27)15(21(31)33-2)10-35-23(12)37-24-20(30)19(29)18(28)17(9-25)36-24/h3-5,8,10,12-13,17-20,23-30H,1,6-7,9H2,2H3/t12?,13?,17-,18-,19+,20-,23?,24?/m0/s1 |
| InChIKey | KJKLKRVCMADLEU-AVIAGFGGSA-N |
| Mol Weight | 526.49 g/mol |
| Molecular Formula | C24H30O13 |
| Exact Mass | 526.168641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B0M2UnPr0O0 |
|---|---|
| Name | 7-GENTISOYLSECOLOGANOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H30O13 |
| InChI | InChI=1S/C24H30O13/c1-3-12-13(6-7-34-22(32)14-8-11(26)4-5-16(14)27)15(21(31)33-2)10-35-23(12)37-24-20(30)19(29)18(28)17(9-25)36-24/h3-5,8,10,12-13,17-20,23-30H,1,6-7,9H2,2H3/t12?,13?,17-,18-,19+,20-,23?,24?/m0/s1 |
| InChIKey | KJKLKRVCMADLEU-AVIAGFGGSA-N |
| Literature Reference Author | E.M.MPONDO,J.GARCIA,J.LESTANI |
| Literature Reference Citation | J.NAT.PROD.,52,1146(1989) |
| Literature Reference DOI | 10.1021/np50065a039 |
| Molecular Weight | 526.494 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWTS514 |