| SpectraBase Compound ID | FZGQUAfbM6O |
|---|---|
| InChI | InChI=1S/C23H28O12/c1-31-15-7-10(2-3-13(15)25)21(30)33-9-11-6-14(26)12-4-5-32-22(17(11)12)35-23-20(29)19(28)18(27)16(8-24)34-23/h2-7,12,14,16-20,22-29H,8-9H2,1H3/t12-,14+,16+,17+,18+,19-,20+,22-,23-/m0/s1 |
| InChIKey | VTYVNBXSLBXSGD-IFWLTBFJSA-N |
| Mol Weight | 496.47 g/mol |
| Molecular Formula | C23H28O12 |
| Exact Mass | 496.158076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7LNXv7Xtr7f |
|---|---|
| Name | PEDUNCULARISIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H28O12 |
| InChI | InChI=1S/C23H28O12/c1-31-15-7-10(2-3-13(15)25)21(30)33-9-11-6-14(26)12-4-5-32-22(17(11)12)35-23-20(29)19(28)18(27)16(8-24)34-23/h2-7,12,14,16-20,22-29H,8-9H2,1H3/t12-,14+,16+,17+,18+,19-,20+,22-,23-/m0/s1 |
| InChIKey | VTYVNBXSLBXSGD-IFWLTBFJSA-N |
| Literature Reference Author | A.SUKSAMRARN,S.KUMPUN,K.KIRTIKARA,B.YINGYONGNARONGKUL,S.SUKS AMRARN |
| Literature Reference Citation | PLANTA.MED.,68,72(2002) |
| Literature Reference DOI | 10.1055/s-2002-20048 |
| Molecular Weight | 496.468 g/mol |
| Solvent | CD3OD |
| Source File Reference | UIAP1673 |