| SpectraBase Compound ID | AQ2pXgXJbYJ |
|---|---|
| InChI | InChI=1S/C26H37NO5S/c1-16-8-7-9-17(2)21(28)13-23(29)26(5,6)24(30)14-25(31)32-22(11-10-16)18(3)12-20-15-33-19(4)27-20/h7-8,10,12,15,17,21-22,24,28,30H,9,11,13-14H2,1-6H3/b8-7+,16-10-,18-12+/t17-,21+,22-,24-/m0/s1 |
| InChIKey | PXFQCMVJCUZHDH-KFOHOXNOSA-N |
| Mol Weight | 475.6 g/mol |
| Molecular Formula | C26H37NO5S |
| Exact Mass | 475.239244 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AHln8uRqZ2Q |
|---|---|
| Name | 6-DESMETHYL-10,11-DIDEHYDROEPOTHILONE-D |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H37NO5S |
| InChI | InChI=1S/C26H37NO5S/c1-16-8-7-9-17(2)21(28)13-23(29)26(5,6)24(30)14-25(31)32-22(11-10-16)18(3)12-20-15-33-19(4)27-20/h7-8,10,12,15,17,21-22,24,28,30H,9,11,13-14H2,1-6H3/b8-7+,16-10-,18-12+/t17-,21+,22-,24-/m0/s1 |
| InChIKey | PXFQCMVJCUZHDH-KFOHOXNOSA-N |
| Literature Reference Author | C.M.STARKS,Y.ZHOU,F.LIU,P.J.LICARI |
| Literature Reference Citation | J.NAT.PROD.,66,1313(2003) |
| Literature Reference DOI | 10.1021/np030218+ |
| Molecular Weight | 475.643 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP1078 |