| SpectraBase Compound ID | ILzDr4rBIWE |
|---|---|
| InChI | InChI=1S/C32H41N3O14/c1-15-10-11-19-27(46-19)29(49-31(33)41)28(48-22(37)9-4-3-7-17-16(2)44-21(13-15)34-17)26-18(45-26)8-5-6-12-43-32(42)35-23-25(39)24(38)20(14-36)47-30(23)40/h3-5,7-9,13,18-20,23-30,36,38-40H,6,10-12,14H2,1-2H3,(H2,33,41)(H,35,42)/b7-3+,8-5+,9-4-,15-13-/t18-,19+,20+,23+,24+,25+,26-,27-,28-,29+,30-/m0/s1 |
| InChIKey | YNWBZPPPFSFTKJ-IJXYZJTNSA-N |
| Mol Weight | 691.7 g/mol |
| Molecular Formula | C32H41N3O14 |
| Exact Mass | 691.258853 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D6hzQEw3hT7 |
|---|---|
| Name | YNWBZPPPFSFTKJ-IJXYZJTNSA-N |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H41N3O14 |
| InChI | InChI=1S/C32H41N3O14/c1-15-10-11-19-27(46-19)29(49-31(33)41)28(48-22(37)9-4-3-7-17-16(2)44-21(13-15)34-17)26-18(45-26)8-5-6-12-43-32(42)35-23-25(39)24(38)20(14-36)47-30(23)40/h3-5,7-9,13,18-20,23-30,36,38-40H,6,10-12,14H2,1-2H3,(H2,33,41)(H,35,42)/b7-3+,8-5+,9-4-,15-13-/t18-,19+,20+,23+,24+,25+,26-,27-,28-,29+,30-/m0/s1 |
| InChIKey | YNWBZPPPFSFTKJ-IJXYZJTNSA-N |
| Literature Reference Author | L.G.ZAR,A.BISHARA,M.AKNIN,D.NEUMANN,N.BEN-CALIFA,Y.KASHMAN |
| Literature Reference Citation | MAR.DRUGS,11,4487(2013) |
| Literature Reference DOI | 10.3390/md11114487 |
| Molecular Weight | 691.689 g/mol |
| Source File Reference | UWBT6624 |