| SpectraBase Compound ID | FLKPWVG8ESc |
|---|---|
| InChI | InChI=1S/C46H67N5O14/c1-25-17-31(64-46(47)58)19-41(56)65-39(20-38(59-8)26(2)13-14-36(54)30(6)43(60-9)27(3)15-16-51(7)24-52)28(4)35(53)11-10-12-40-48-33(22-61-40)44-50-34(23-63-44)45-49-32(21-62-45)42(57)29(5)37(55)18-25/h10,12,15-16,21-31,35,37-39,42-43,53,55,57H,11,13-14,17-20H2,1-9H3,(H2,47,58)/b12-10+,16-15+/t25-,26-,27+,28+,29-,30-,31-,35-,37-,38-,39-,42+,43+/m0/s1 |
| InChIKey | VXRUIPMXEQHYMT-PNYLVMIPSA-N |
| Mol Weight | 914.1 g/mol |
| Molecular Formula | C46H67N5O14 |
| Exact Mass | 913.468452 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | jiCjt7Pw7K |
|---|---|
| Name | 9-O-DESMETHYL_KABIRAMIDE_B;MAJOR_ISOMER |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H67N5O14 |
| InChI | InChI=1S/C46H67N5O14/c1-25-17-31(64-46(47)58)19-41(56)65-39(20-38(59-8)26(2)13-14-36(54)30(6)43(60-9)27(3)15-16-51(7)24-52)28(4)35(53)11-10-12-40-48-33(22-61-40)44-50-34(23-63-44)45-49-32(21-62-45)42(57)29(5)37(55)18-25/h10,12,15-16,21-31,35,37-39,42-43,53,55,57H,11,13-14,17-20H2,1-9H3,(H2,47,58)/b12-10+,16-15+/t25-,26-,27+,28+,29-,30-,31-,35-,37-,38-,39-,42+,43+/m0/s1 |
| InChIKey | VXRUIPMXEQHYMT-PNYLVMIPSA-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 | 914.063 g/mol |
| Sample ID | 32468 |
| Solvent | CDCl3 |