| SpectraBase Compound ID | 9QlMyjRA9MO |
|---|---|
| InChI | InChI=1S/C42H61N7O8/c1-7-26(3)34-39(53)44-32(23-22-29-17-11-9-12-18-29)40(54)49(6)28(5)36(50)45-33(25-30-19-13-10-14-20-30)37(51)43-24-16-15-21-31(38(52)47-34)46-42(57)48-35(41(55)56)27(4)8-2/h9-14,17-20,26-28,31-35H,7-8,15-16,21-25H2,1-6H3,(H,43,51)(H,44,53)(H,45,50)(H,47,52)(H,55,56)(H2,46,48,57)/t26-,27-,28+,31-,32+,33+,34+,35-/m1/s1 |
| InChIKey | UHGIIADZWWCEKS-AYXSHULJSA-N |
| Mol Weight | 792.0 g/mol |
| Molecular Formula | C42H61N7O8 |
| Exact Mass | 791.458162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1SfDdB31c4Q |
|---|---|
| Name | SCHIZOPEPTIN-791 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H61N7O8 |
| InChI | InChI=1S/C42H61N7O8/c1-7-26(3)34-39(53)44-32(23-22-29-17-11-9-12-18-29)40(54)49(6)28(5)36(50)45-33(25-30-19-13-10-14-20-30)37(51)43-24-16-15-21-31(38(52)47-34)46-42(57)48-35(41(55)56)27(4)8-2/h9-14,17-20,26-28,31-35H,7-8,15-16,21-25H2,1-6H3,(H,43,51)(H,44,53)(H,45,50)(H,47,52)(H,55,56)(H2,46,48,57)/t26-,27-,28+,31-,32+,33+,34+,35-/m1/s1 |
| InChIKey | UHGIIADZWWCEKS-AYXSHULJSA-N |
| Literature Reference Author | V.RESHEF,S.CARMELI |
| Literature Reference Citation | J.NAT.PROD.,65,1187(2002) |
| Literature Reference DOI | 10.1021/np020039c |
| Molecular Weight | 791.988 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI6321 |