| SpectraBase Compound ID | BF6eqFu4ahp |
|---|---|
| InChI | InChI=1S/C26H32O13/c1-13(27)39-25(2)11-17(29)26(34)9-10-35-24(22(25)26)38-23-21(33)20(32)19(31)16(37-23)12-36-18(30)8-5-14-3-6-15(28)7-4-14/h3-10,16-17,19-24,28-29,31-34H,11-12H2,1-2H3/b8-5+/t16-,17+,19-,20+,21-,22+,23+,24-,25-,26+/m0/s1 |
| InChIKey | AWAQIKGSHQDRLL-CMWPWFCNSA-N |
| Mol Weight | 552.5 g/mol |
| Molecular Formula | C26H32O13 |
| Exact Mass | 552.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATuNSFv7RlX |
|---|---|
| Name | 8-O-ACETYL-6'-O-(PARA-COUMAROYL)-HARPAGIDE |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H32O13 |
| InChI | InChI=1S/C26H32O13/c1-13(27)39-25(2)11-17(29)26(34)9-10-35-24(22(25)26)38-23-21(33)20(32)19(31)16(37-23)12-36-18(30)8-5-14-3-6-15(28)7-4-14/h3-10,16-17,19-24,28-29,31-34H,11-12H2,1-2H3/b8-5+/t16-,17+,19-,20+,21-,22+,23+,24-,25-,26+/m0/s1 |
| InChIKey | AWAQIKGSHQDRLL-CMWPWFCNSA-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 | 552.532 g/mol |
| Sample ID | 37822 |
| Solvent | CDCl3 |