| SpectraBase Compound ID | KLnciJrAGE3 |
|---|---|
| InChI | InChI=1S/C33H56N2O11/c1-12-23-33(8,41)28(39)19(4)25(37)17(2)16-32(7,42-11)29(46-31-26(38)22(35(9)10)15-18(3)43-31)20(5)27(21(6)30(40)44-23)45-24(36)13-14-34/h17-23,26-29,31,38-39,41H,12-13,15-16H2,1-11H3/t17-,18-,19+,20+,21-,22+,23-,26-,27+,28-,29-,31+,32+,33-/m1/s1 |
| InChIKey | SNJWSUZHJOOMQO-HWEHISENSA-N |
| Mol Weight | 656.8 g/mol |
| Molecular Formula | C33H56N2O11 |
| Exact Mass | 656.388411 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Xuqu7x0aNc |
|---|---|
| Name | SNJWSUZHJOOMQO-HWEHISENSA-N |
| Compound Number | 3B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H56N2O11 |
| InChI | InChI=1S/C33H56N2O11/c1-12-23-33(8,41)28(39)19(4)25(37)17(2)16-32(7,42-11)29(46-31-26(38)22(35(9)10)15-18(3)43-31)20(5)27(21(6)30(40)44-23)45-24(36)13-14-34/h17-23,26-29,31,38-39,41H,12-13,15-16H2,1-11H3/t17-,18-,19+,20+,21-,22+,23-,26-,27+,28-,29-,31+,32+,33-/m1/s1 |
| InChIKey | SNJWSUZHJOOMQO-HWEHISENSA-N |
| Literature Reference Author | T.TANIKAWA,T.ASAKA,M.KASHIMURA,Y.MISAWA,K.SUZUKI,M.SATO,K.KA MEO,S.MORIMOTO,A.NIS |
| Literature Reference Citation | J.MED.CHEM.,44,4027(2001) |
| Literature Reference DOI | 10.1021/jm015566s |
| Molecular Weight | 656.814 g/mol |
| Sample ID | 45171 |
| Solvent | CDCl3 |