basic_info |
|
| Product_Name: | MAYTANSINE, O3-ACETYL-O3-DE2-(ACETYLMETHYLAMINO)-1-OXOPROPYL-22-DEMETHYL- |
| CAS: | 77353-67-4 |
| EnglishSynonyms: | MAYTANSINE, O3-ACETYL-O3-DE2-(ACETYLMETHYLAMINO)-1-OXOPROPYL-22-DEMETHYL- |
| pro_mdlNumber: | MFCD01939726 |
| pro_acceptors: | 11 |
| pro_donors: | 3 |
| pro_smile: | C[C@@H]1[C@@H]2C[C@]([C@@H](/C=C/C=C(/Cc3cc(c(c(c3)OC)Cl)NC(=O)C[C@@H]([C@]4([C@@H]1O4)C)OC(=O)C)\C)OC)(NC(=O)O2)O |
| InChi: | InChI=1S/C29H37ClN2O9/c1-15-8-7-9-22(38-6)29(36)14-21(40-27(35)32-29)16(2)26-28(4,41-26)23(39-17(3)33)13-24(34)31-19-11-18(10-15)12-20(37-5)25(19)30/h7-9,11-12,16,21-23,26,36H,10,13-14H2,1-6H3,(H,31,34)(H,32,35)/b9-7+,15-8+/t16-,21+,22-,23+,26-,28+,29+/m1/s1 |
| InChiKey: | InChIKey=IDPXHMRTHALESG-SJELLPTDSA-N |
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