Ansamitocin Pdm-3
[CAS# 77353-69-6]

Identification

• Name: Ansamitocin Pdm-3
• Synonyms: Antibiotic C 15003Pnd-3; Antibiotic C-15003 Pdm-3; Maytansine, 2'-De(Acetylmethylamino)-22-Demethyl-2'-Methyl-
• Molecular Formula: C₃₁H₄₁ClN₂O₉
• Molecular Weight: 621.13
• CAS Registry Number: 77353-69-6
• SMILES: [C@]14(O[C@H]1[C@@H]([C@H]2OC(=O)N[C@](O)(C2)[C@H](OC)\C=C\C=C(CC3=CC(=C(Cl)C(=C3)OC)NC(=O)C[C@@H]4OC(=O)C(C)C)/C)C)C
• InChI: 1S/C31H41ClN2O9/c1-16(2)28(36)42-24-14-25(35)33-20-12-19(13-21(39-6)26(20)32)11-17(3)9-8-10-23(40-7)31(38)15-22(41-29(37)34-31)18(4)27-30(24,5)43-27/h8-10,12-13,16,18,22-24,27,38H,11,14-15H2,1-7H3,(H,33,35)(H,34,37)/b10-8+,17-9+/t18-,22+,23-,24+,27+,30+,31+/m1/s1
• InChIKey: BOYNDXJJKZMFBK-PRWXLFGZSA-N