| SpectraBase Compound ID | 6jCi7JpYXpN |
|---|---|
| InChI | InChI=1S/C26H37NO5S/c1-15-8-7-9-16(2)25(30)19(5)26(31)18(4)22(28)13-24(29)32-23(11-10-15)17(3)12-21-14-33-20(6)27-21/h7-8,10,12,14,16,18-19,22-23,25,28,30H,9,11,13H2,1-6H3/b8-7+,15-10-,17-12+/t16-,18?,19+,22-,23-,25-/m0/s1 |
| InChIKey | CMYNODDHYRKQSA-UPKVHMKOSA-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 | BnZVCmxuYkn |
|---|---|
| Name | 4-DESMETHYL-10,11-DIDEHYDROEPOTHILONE-D |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H37NO5S |
| InChI | InChI=1S/C26H37NO5S/c1-15-8-7-9-16(2)25(30)19(5)26(31)18(4)22(28)13-24(29)32-23(11-10-15)17(3)12-21-14-33-20(6)27-21/h7-8,10,12,14,16,18-19,22-23,25,28,30H,9,11,13H2,1-6H3/b8-7+,15-10-,17-12+/t16-,18?,19+,22-,23-,25-/m0/s1 |
| InChIKey | CMYNODDHYRKQSA-UPKVHMKOSA-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 | UWSP1077 |