| SpectraBase Compound ID | 3Ase3e2G0L6 |
|---|---|
| InChI | InChI=1S/C34H46ClN3O10/c1-18-11-10-12-26(45-9)34(43)17-25(46-32(42)36-34)19(2)30-33(5,48-30)27(47-31(41)20(3)37(6)21(4)39)16-28(40)38(7)23-14-22(13-18)15-24(44-8)29(23)35/h10-12,14-15,19-20,25-27,30,43H,13,16-17H2,1-9H3,(H,36,42)/b12-10+,18-11+/t19-,20-,25?,26+,27-,30-,33-,34-/m0/s1 |
| InChIKey | WKPWGQKGSOKKOO-AIUHMOPZSA-N |
| Mol Weight | 692.2 g/mol |
| Molecular Formula | C34H46ClN3O10 |
| Exact Mass | 691.287172 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DzSjMTEgTeN |
|---|---|
| Name | MAYTANSINE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H46ClN3O10 |
| InChI | InChI=1S/C34H46ClN3O10/c1-18-11-10-12-26(45-9)34(43)17-25(46-32(42)36-34)19(2)30-33(5,48-30)27(47-31(41)20(3)37(6)21(4)39)16-28(40)38(7)23-14-22(13-18)15-24(44-8)29(23)35/h10-12,14-15,19-20,25-27,30,43H,13,16-17H2,1-9H3,(H,36,42)/b12-10+,18-11+/t19-,20-,25?,26+,27-,30-,33-,34-/m0/s1 |
| InChIKey | WKPWGQKGSOKKOO-AIUHMOPZSA-N |
| Literature Reference Author | W.A.WALLACE,A.T.SNEDEN |
| Literature Reference Citation | ORG.MAGN.RES.,19,31(1982) |
| Literature Reference DOI | 10.1002/mrc.1270190109 |
| Molecular Weight | 692.206 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS12277 |