| SpectraBase Compound ID | 1LynS1kPp3w |
|---|---|
| InChI | InChI=1S/C28H41N3O8/c1-6-17(4)26(35)30-20(14-19-10-8-7-9-11-19)28(37)39-22(15-23(33)34)25-21(38-18(5)32)12-13-31(25)27(36)24(29)16(2)3/h7-11,16-17,20-22,24-25H,6,12-15,29H2,1-5H3,(H,30,35)(H,33,34)/t17?,20-,21+,22-,24+,25-/m1/s1 |
| InChIKey | GOZDOQQVOQTNBQ-GPQKPWSESA-N |
| Mol Weight | 547.6 g/mol |
| Molecular Formula | C28H41N3O8 |
| Exact Mass | 547.289365 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 | AWrdkA8nRrn |
|---|---|
| Name | DETOXIN-D1 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H41N3O8 |
| InChI | InChI=1S/C28H41N3O8/c1-6-17(4)26(35)30-20(14-19-10-8-7-9-11-19)28(37)39-22(15-23(33)34)25-21(38-18(5)32)12-13-31(25)27(36)24(29)16(2)3/h7-11,16-17,20-22,24-25H,6,12-15,29H2,1-5H3,(H,30,35)(H,33,34)/t17?,20-,21+,22-,24+,25-/m1/s1 |
| InChIKey | GOZDOQQVOQTNBQ-GPQKPWSESA-N |
| Literature Reference Author | T.OGITA,N.OTAKE,K.KAKINUMA,H.YONEHARA |
| Literature Reference Citation | AGR.BIOL.CHEM.,42,2403(1978) |
| Literature Reference DOI | 10.1271/bbb1961.42.2403 |
| Molecular Weight | 547.649 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT8654 |