| SpectraBase Compound ID | 1pEnSaEaTCT |
|---|---|
| InChI | InChI=1S/C24H28O12/c1-23-18-22(35-21-17(30)16(29)15(28)13(10-25)33-21)32-9-8-24(18,31)20(19(23)36-23)34-14(27)7-4-11-2-5-12(26)6-3-11/h2-9,13,15-22,25-26,28-31H,10H2,1H3/b7-4+/t13-,15-,16+,17-,18+,19-,20+,21+,22-,23+,24-/m0/s1 |
| InChIKey | FUUBBPBQJSJZFW-HMGHTJMVSA-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 | IbdNRZtZ168 |
|---|---|
| Name | 6-O-TRANS-PARA-COUMAROYL-ANTIRRINOSIDE |
| Compound Number | 1 |
| 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(35-21-17(30)16(29)15(28)13(10-25)33-21)32-9-8-24(18,31)20(19(23)36-23)34-14(27)7-4-11-2-5-12(26)6-3-11/h2-9,13,15-22,25-26,28-31H,10H2,1H3/b7-4+/t13-,15-,16+,17-,18+,19-,20+,21+,22-,23+,24-/m0/s1 |
| InChIKey | FUUBBPBQJSJZFW-HMGHTJMVSA-N |
| Literature Reference Author | E.I.ILIEVA,N.V.HANDJIEVA,S.S.POPOV |
| Literature Reference Citation | PHYTOCHEM.,31,1040(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80068-p |
| Molecular Weight | 508.479 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN5044 |