| SpectraBase Compound ID | LwvEPR0Q9IG |
|---|---|
| InChI | InChI=1S/C27H43NO8/c1-7-28-12-24(13-36-14(2)29)9-8-18(33-4)26-16-10-15-17(32-3)11-25(30,19(16)20(15)34-5)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1 |
| InChIKey | STJQAAPRZLERIZ-JJQLKCKLSA-N |
| Mol Weight | 509.6 g/mol |
| Molecular Formula | C27H43NO8 |
| Exact Mass | 509.298867 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8CcntUv6YdD |
|---|---|
| Name | ACETYLLYCOCTONINE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H43NO8 |
| InChI | InChI=1S/C27H43NO8/c1-7-28-12-24(13-36-14(2)29)9-8-18(33-4)26-16-10-15-17(32-3)11-25(30,19(16)20(15)34-5)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1 |
| InChIKey | STJQAAPRZLERIZ-JJQLKCKLSA-N |
| Literature Reference Author | X.L.SHEN,F.P.WANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,53,267(2005) |
| Literature Reference DOI | 10.1248/cpb.53.267 |
| Molecular Weight | 509.640 g/mol |
| Sample ID | 54089 |
| Solvent | CDCl3 |