| SpectraBase Compound ID | 4J8SVsuCXzZ |
|---|---|
| InChI | InChI=1S/C24H28O12/c1-23-18-22(32-9-8-24(18,31)19(30)20(23)36-23)35-21-17(29)16(28)15(27)13(34-21)10-33-14(26)7-4-11-2-5-12(25)6-3-11/h2-9,13,15-22,25,27-31H,10H2,1H3/b7-4-/t13-,15-,16+,17-,18+,19-,20-,21+,22-,23+,24-/m0/s1 |
| InChIKey | PRYABGKDJFUETA-DAPCFGPESA-N |
| Mol Weight | 508.48 g/mol |
| Molecular Formula | C24H28O12 |
| Exact Mass | 508.158076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1oYq4r7pYI |
|---|---|
| Name | HARPROCUMBIDE-B;6''-O-(CIS-PARA-COUMAROYL)-PROCUMBIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H28O12 |
| InChI | InChI=1S/C24H28O12/c1-23-18-22(32-9-8-24(18,31)19(30)20(23)36-23)35-21-17(29)16(28)15(27)13(34-21)10-33-14(26)7-4-11-2-5-12(25)6-3-11/h2-9,13,15-22,25,27-31H,10H2,1H3/b7-4-/t13-,15-,16+,17-,18+,19-,20-,21+,22-,23+,24-/m0/s1 |
| InChIKey | PRYABGKDJFUETA-DAPCFGPESA-N |
| Literature Reference Author | J.QI,J.J.CHEN,Z.H.CHENG,J.H.ZHOU,B.Y.YU,S.X.QIU |
| Literature Reference Citation | PHYTOCHEM.,67,1372(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.05.029 |
| Molecular Weight | 508.479 g/mol |
| Sample ID | 67038 |
| Solvent | C5D5N |