| SpectraBase Compound ID | JYJ9YqToSaa |
|---|---|
| InChI | InChI=1S/C25H30O12/c1-33-17-8-12(2-4-15(17)27)3-5-19(29)35-11-13-9-16(28)14-6-7-34-24(20(13)14)37-25-23(32)22(31)21(30)18(10-26)36-25/h2-9,14,16,18,20-28,30-32H,10-11H2,1H3/b5-3+/t14-,16+,18-,20+,21-,22+,23-,24-,25+/m0/s1 |
| InChIKey | UBIOBPKBEZMDGP-SBALHZABSA-N |
| Mol Weight | 522.5 g/mol |
| Molecular Formula | C25H30O12 |
| Exact Mass | 522.173726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | COKpD738nhQ |
|---|---|
| Name | ACUMINATUSIDE;10-(E)-FERULOYL-AUCUBIN |
| Compound Number | 45 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30O12 |
| InChI | InChI=1S/C25H30O12/c1-33-17-8-12(2-4-15(17)27)3-5-19(29)35-11-13-9-16(28)14-6-7-34-24(20(13)14)37-25-23(32)22(31)21(30)18(10-26)36-25/h2-9,14,16,18,20-28,30-32H,10-11H2,1H3/b5-3+/t14-,16+,18-,20+,21-,22+,23-,24-,25+/m0/s1 |
| InChIKey | UBIOBPKBEZMDGP-SBALHZABSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,Y.HARIGAYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,159(2007) |
| Literature Reference DOI | 10.1248/cpb.55.159 |
| Molecular Weight | 522.506 g/mol |
| Sample ID | 37845 |
| Solvent | CD3OD |