| SpectraBase Compound ID | IJ5p9WeEAX0 |
|---|---|
| InChI | InChI=1S/C33H43N5O4/c1-7-21(4)29(38(5)6)33(41)37-28-30(20(2)3)42-24-14-12-22(13-15-24)16-17-34-31(39)27(36-32(28)40)18-23-19-35-26-11-9-8-10-25(23)26/h8-17,19-21,27-30,35H,7,18H2,1-6H3,(H,34,39)(H,36,40)(H,37,41)/b17-16-/t21?,27-,28?,29-,30?/m0/s1 |
| InChIKey | SCJZVYYNGPHJMK-QXZRDBOLSA-N |
| Mol Weight | 573.7 g/mol |
| Molecular Formula | C33H43N5O4 |
| Exact Mass | 573.331505 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 | EtZKlfurWQw |
|---|---|
| Name | DISCASINE_B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H43N5O4 |
| InChI | InChI=1S/C33H43N5O4/c1-7-21(4)29(38(5)6)33(41)37-28-30(20(2)3)42-24-14-12-22(13-15-24)16-17-34-31(39)27(36-32(28)40)18-23-19-35-26-11-9-8-10-25(23)26/h8-17,19-21,27-30,35H,7,18H2,1-6H3,(H,34,39)(H,36,40)(H,37,41)/b17-16-/t21?,27-,28?,29-,30?/m0/s1 |
| InChIKey | SCJZVYYNGPHJMK-QXZRDBOLSA-N |
| Literature Reference Author | G.TREVISAN,G.MALDANER,N.A.VELLOSO,G.D.S.SANTANNA,V.ILHA,C.D. C.V.GEWEHR,M.A.RUBIN |
| Literature Reference Citation | J.NAT.PROD.,72,608(2009) |
| Literature Reference DOI | 10.1021/np800377y |
| Molecular Weight | 573.736 g/mol |
| Sample ID | 32346 |
| Solvent | CDCl3 |