| SpectraBase Compound ID | ITeWBg09ntv |
|---|---|
| InChI | InChI=1S/C40H57N3O14/c1-4-22(2)37(51)43-18-8-16-42-30(45)19-28(41-17-15-26(44)20-43)24-11-13-27(14-12-24)55-40-36(34(49)31(46)23(3)54-40)57-39-35(50)33(48)32(47)29(56-39)21-53-38(52)25-9-6-5-7-10-25/h5-7,9-14,22-23,26,28-29,31-36,39-41,44,46-50H,4,8,15-21H2,1-3H3,(H,42,45)/t22-,23-,26+,28-,29+,31-,32+,33-,34+,35+,36+,39-,40-/m0/s1 |
| InChIKey | QZCPRWHWMRBQQI-RDNOUEAJSA-N |
| Mol Weight | 803.9 g/mol |
| Molecular Formula | C40H57N3O14 |
| Exact Mass | 803.384054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KhheDrbWeoe |
|---|---|
| Name | MEEHANINE_B;ISOMER_2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H57N3O14 |
| InChI | InChI=1S/C40H57N3O14/c1-4-22(2)37(51)43-18-8-16-42-30(45)19-28(41-17-15-26(44)20-43)24-11-13-27(14-12-24)55-40-36(34(49)31(46)23(3)54-40)57-39-35(50)33(48)32(47)29(56-39)21-53-38(52)25-9-6-5-7-10-25/h5-7,9-14,22-23,26,28-29,31-36,39-41,44,46-50H,4,8,15-21H2,1-3H3,(H,42,45)/t22-,23-,26+,28-,29+,31-,32+,33-,34+,35+,36+,39-,40-/m0/s1 |
| InChIKey | QZCPRWHWMRBQQI-RDNOUEAJSA-N |
| Literature Reference Author | T.MURATA,T.MIYASE,T.WARASHINA,F.YOSHIZAKI |
| Literature Reference Citation | J.NAT.PROD.,72,1049(2009) |
| Literature Reference DOI | 10.1021/np800691k |
| Molecular Weight | 803.904 g/mol |
| Sample ID | 32721 |
| Solvent | CD3OD |