| SpectraBase Compound ID | HNC9ivxKsfH |
|---|---|
| InChI | InChI=1S/C41H59N7O9/c1-7-25(4)34(40(55)56)47-41(57)45-30-15-11-12-22-42-36(51)32(23-28-13-9-8-10-14-28)44-35(50)26(5)48(6)39(54)31(21-18-27-16-19-29(49)20-17-27)43-38(53)33(24(2)3)46-37(30)52/h8-10,13-14,16-17,19-20,24-26,30-34,49H,7,11-12,15,18,21-23H2,1-6H3,(H,42,51)(H,43,53)(H,44,50)(H,46,52)(H,55,56)(H2,45,47,57) |
| InChIKey | QRBPBHIXDXCIEN-UHFFFAOYSA-N |
| Mol Weight | 794.0 g/mol |
| Molecular Formula | C41H59N7O9 |
| Exact Mass | 793.437426 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HgcdnCWxWHI |
|---|---|
| Name | ANABAENOPEPTIN-J |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H59N7O9 |
| InChI | InChI=1S/C41H59N7O9/c1-7-25(4)34(40(55)56)47-41(57)45-30-15-11-12-22-42-36(51)32(23-28-13-9-8-10-14-28)44-35(50)26(5)48(6)39(54)31(21-18-27-16-19-29(49)20-17-27)43-38(53)33(24(2)3)46-37(30)52/h8-10,13-14,16-17,19-20,24-26,30-34,49H,7,11-12,15,18,21-23H2,1-6H3,(H,42,51)(H,43,53)(H,44,50)(H,46,52)(H,55,56)(H2,45,47,57) |
| InChIKey | QRBPBHIXDXCIEN-UHFFFAOYSA-N |
| Literature Reference Author | M.MURAKAMI,S.SUZUKI,Y.ITOU,S.KOTANI,K.ISHIDA |
| Literature Reference Citation | J.NAT.PROD.,63,1280(2000) |
| Literature Reference DOI | 10.1021/np000120k |
| Molecular Weight | 793.961 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWGE3988 |