| SpectraBase Compound ID | GbHX1ioDTYh |
|---|---|
| InChI | InChI=1S/C31H34O13/c1-29-13-20(33)19-12-31(29,30(19,28(39-2)44-29)15-41-26(38)17-8-10-18(32)11-9-17)43-27-24(36)23(35)22(34)21(42-27)14-40-25(37)16-6-4-3-5-7-16/h3-11,19,21-24,27-28,32,34-36H,12-15H2,1-2H3/t19-,21-,22-,23+,24-,27+,28-,29+,30-,31+/m0/s1 |
| InChIKey | PBDROKLULCIDPL-ROPMQBEHSA-N |
| Mol Weight | 614.6 g/mol |
| Molecular Formula | C31H34O13 |
| Exact Mass | 614.199941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L9KRxX1xUJK |
|---|---|
| Name | PAEONIDANIN-C |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H34O13 |
| InChI | InChI=1S/C31H34O13/c1-29-13-20(33)19-12-31(29,30(19,28(39-2)44-29)15-41-26(38)17-8-10-18(32)11-9-17)43-27-24(36)23(35)22(34)21(42-27)14-40-25(37)16-6-4-3-5-7-16/h3-11,19,21-24,27-28,32,34-36H,12-15H2,1-2H3/t19-,21-,22-,23+,24-,27+,28-,29+,30-,31+/m0/s1 |
| InChIKey | PBDROKLULCIDPL-ROPMQBEHSA-N |
| Literature Reference Author | L.DING,Z.JIANG,Y.LIU,L.CHEN,Q.ZHAO,X.YAO,F.ZHAO,F.QIU |
| Literature Reference Citation | FITOTERAPIA,83,1598(2012) |
| Literature Reference DOI | 10.1016/j.fitote.2012.09.008 |
| Molecular Weight | 614.603 g/mol |
| Sample ID | 72104 |
| Solvent | CD3OD |