| SpectraBase Compound ID | 9BtF1HvVsbU |
|---|---|
| InChI | InChI=1S/C23H34O6/c1-13(24)22(27)9-10-23(28)17-6-5-15-11-16(26)7-8-20(15,3)18(17)12-19(21(22,23)4)29-14(2)25/h5,16-19,26-28H,6-12H2,1-4H3/t16-,17+,18-,19+,20-,21+,22+,23-/m0/s1 |
| InChIKey | WDCMSEUYWDHPQI-XKGWPCTASA-N |
| Mol Weight | 406.5 g/mol |
| Molecular Formula | C23H34O6 |
| Exact Mass | 406.235539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5TcT8s2pCKk |
|---|---|
| Name | 12-O-ACETYL-PERGULARIN |
| Compound Number | III |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H34O6 |
| InChI | InChI=1S/C23H34O6/c1-13(24)22(27)9-10-23(28)17-6-5-15-11-16(26)7-8-20(15,3)18(17)12-19(21(22,23)4)29-14(2)25/h5,16-19,26-28H,6-12H2,1-4H3/t16-,17+,18-,19+,20-,21+,22+,23-/m0/s1 |
| InChIKey | WDCMSEUYWDHPQI-XKGWPCTASA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,1752(1998) |
| Literature Reference DOI | 10.1248/cpb.46.1752 |
| Molecular Weight | 406.519 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS20842 |