| SpectraBase Compound ID | 7cqaJkjCV2l |
|---|---|
| InChI | InChI=1S/C27H36N2O5S/c1-16-5-8-20(9-6-16)35(32,33)29-28-19-13-21(25(31)34-4)22-11-12-27-14-18(17(2)24(27)30)7-10-23(27)26(22,3)15-19/h5-6,8-9,18,21-24,29-30H,2,7,10-15H2,1,3-4H3/b28-19+/t18-,21-,22-,23+,24-,26-,27-/m1/s1 |
| InChIKey | RRSOQDSHBRDCHG-KTHBXWJBSA-N |
| Mol Weight | 500.7 g/mol |
| Molecular Formula | C27H36N2O5S |
| Exact Mass | 500.234493 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 | EpyyjJoyVi9 |
|---|---|
| Name | RRSOQDSHBRDCHG-KTHBXWJBSA-N |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36N2O5S |
| InChI | InChI=1S/C27H36N2O5S/c1-16-5-8-20(9-6-16)35(32,33)29-28-19-13-21(25(31)34-4)22-11-12-27-14-18(17(2)24(27)30)7-10-23(27)26(22,3)15-19/h5-6,8-9,18,21-24,29-30H,2,7,10-15H2,1,3-4H3/b28-19+/t18-,21-,22-,23+,24-,26-,27-/m1/s1 |
| InChIKey | RRSOQDSHBRDCHG-KTHBXWJBSA-N |
| Literature Reference Author | S.ROSSELLI,M.BRUNO,A.MAGGIO,G.BELLONE,T.H.CHEN,K.F.BASTOW,K. H.LEE |
| Literature Reference Citation | J.NAT.PROD.,70,347(2007) |
| Literature Reference DOI | 10.1021/np060504w |
| Molecular Weight | 500.653 g/mol |
| Sample ID | 30031 |
| Solvent | CDCl3 |