| SpectraBase Compound ID | 9eDXDbHFtM9 |
|---|---|
| InChI | InChI=1S/C35H48ClN3O10/c1-10-28(40)38(6)21(4)32(42)48-27-17-29(41)39(7)23-15-22(16-24(45-8)30(23)36)14-19(2)12-11-13-26(46-9)35(44)18-25(47-33(43)37-35)20(3)31-34(27,5)49-31/h11-13,15-16,20-21,25-27,31,44H,10,14,17-18H2,1-9H3,(H,37,43)/b13-11-,19-12- |
| InChIKey | BVXGVRDMHBYRCQ-XNCYGOCXSA-N |
| Mol Weight | 706.2 g/mol |
| Molecular Formula | C35H48ClN3O10 |
| Exact Mass | 705.302822 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Itz4ZRUnVsz |
|---|---|
| Name | Maytanprine |
| CAS Registry Number | 38997-09-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H48ClN3O10 |
| InChI | InChI=1S/C35H48ClN3O10/c1-10-28(40)38(6)21(4)32(42)48-27-17-29(41)39(7)23-15-22(16-24(45-8)30(23)36)14-19(2)12-11-13-26(46-9)35(44)18-25(47-33(43)37-35)20(3)31-34(27,5)49-31/h11-13,15-16,20-21,25-27,31,44H,10,14,17-18H2,1-9H3,(H,37,43)/b13-11-,19-12- |
| InChIKey | BVXGVRDMHBYRCQ-XNCYGOCXSA-N |
| Molecular Weight | 706.233 g/mol |
| SMILES | OC12CC(C(C3C(C)(C(CC(N(c4cc(C\C(=C/C=C\C2OC)C)cc(OC)c4Cl)C)=O)OC(C(N(C(CC)=O)C)C)=O)O3)C)OC(N1)=O |
| SPLASH | splash10-01ox-0920300000-9859b8fb6f31ee985654 |
| Source of Spectrum | W5-1989-38091-27445 |
| Synonyms | Maytansine, N(2')-deacetyl-N(2')-(1-oxopropyl)- N(2')-deacetyl-n(2')-(1-oxopropyl)maytansine NSC 165013 |
| Wiley ID | 1415183 |