Ethyl N-(O-4-deacetyl-vinblastin-23-oyl)-L-leucinate
[CAS# 81571-25-7]

Identification

• Name: Ethyl N-(O-4-deacetyl-vinblastin-23-oyl)-L-leucinate
• Synonyms: Vle; Vincaleukoblastine, O(Sup 4)-Deacetyl-3-De(Methoxycarbonyl)-3-(((1-(Ethoxycarbonyl)-3-Methylbutyl)Amino)Carbonyl)-, (3(R))-
• Molecular Formula: C₅₁H₆₉N₅O₉
• Molecular Weight: 896.13
• CAS Registry Number: 81571-25-7
• SMILES: C2=C1C78C(N(C1=CC(=C2C5(C4=C(C3=CC=CC=C3[NH]4)CCN6CC(C5)CC(O)(C6)CC)C(OC)=O)OC)C)C(O)(C(O)C9(C7N(CC8)CC=C9)CC)C(=O)NC(C(OCC)=O)CC(C)C
• InChI: 1S/C51H69N5O9/c1-9-47(61)26-31-27-50(46(60)64-8,40-33(17-21-55(28-31)29-47)32-15-12-13-16-36(32)52-40)35-24-34-38(25-39(35)63-7)54(6)43-49(34)19-22-56-20-14-18-48(10-2,42(49)56)44(58)51(43,62)45(59)53-37(23-30(4)5)41(57)65-11-3/h12-16,18,24-25,30-31,37,42-44,52,58,61-62H,9-11,17,19-23,26-29H2,1-8H3,(H,53,59)
• InChIKey: OZPPQAAESSDMFW-UHFFFAOYSA-N

Properties

• Density: 1.338g/cm³ (Cal.)