| SpectraBase Compound ID | 7r8k8sfEoqj |
|---|---|
| InChI | InChI=1S/C33H42N8O6S2/c1-16(2)12-19-32(45)41-11-7-9-24(41)31-38-22(15-49-31)29-36-20(13-47-29)33(46)40-10-6-8-23(40)27(43)39-25(17(3)4)28(44)34-18(5)30-37-21(14-48-30)26(42)35-19/h13-19,23-25H,6-12H2,1-5H3,(H,34,44)(H,35,42)(H,39,43)/t18-,19-,23-,24-,25-/m0/s1 |
| InChIKey | FDDMSTZRSIHETC-ZGTHKHSNSA-N |
| Mol Weight | 710.9 g/mol |
| Molecular Formula | C33H42N8O6S2 |
| Exact Mass | 710.266873 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BLCtAgZsBYi |
|---|---|
| Name | SANGUINAMIDE_B |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42N8O6S2 |
| InChI | InChI=1S/C33H42N8O6S2/c1-16(2)12-19-32(45)41-11-7-9-24(41)31-38-22(15-49-31)29-36-20(13-47-29)33(46)40-10-6-8-23(40)27(43)39-25(17(3)4)28(44)34-18(5)30-37-21(14-48-30)26(42)35-19/h13-19,23-25H,6-12H2,1-5H3,(H,34,44)(H,35,42)(H,39,43)/t18-,19-,23-,24-,25-/m0/s1 |
| InChIKey | FDDMSTZRSIHETC-ZGTHKHSNSA-N |
| Literature Reference Author | D.S.DALISAY,E.W.ROGERS,A.S.EDISON,T.F.MOLINSKI |
| Literature Reference Citation | J.NAT.PROD.,72,732(2009) |
| Literature Reference DOI | 10.1021/np8007649 |
| Molecular Weight | 710.866 g/mol |
| Sample ID | 32473 |
| Solvent | CDCl3 |