O4-Deacetyl-3-De(Methoxycarbonyl)-3-((((1S)-1-(Diethoxyphosphinyl)-2-Methylpropyl)Amino)Carbonyl)-Vincaleukoblastine
[CAS# 123286-00-0]

Identification

• Name: O4-Deacetyl-3-De(Methoxycarbonyl)-3-((((1S)-1-(Diethoxyphosphinyl)-2-Methylpropyl)Amino)Carbonyl)-Vincaleukoblastine
• Synonyms: Vincaleukoblastine, O4-Deacetyl-3-De(Methoxycarbonyl)-3-(((1-(Diethoxyphosphinyl)-2-Methylpropyl)Amino)Carbonyl)-, (3(S))-; Vinfosiltine; Vinfosiltine [Inn]
• Molecular Formula: C₅₁H₇₂N₅O₁₀P
• Molecular Weight: 946.13
• CAS Registry Number: 123286-00-0
• SMILES: [C@@H]14N(C5=C(C12[C@H]3N(CC2)CC=C[C@]3([C@@H](O)[C@]4(O)C(=O)N[C@H]([P](OCC)(OCC)=O)C(C)C)CC)C=C(C(=C5)OC)[C@@]8(C6=C(C7=C([NH]6)C=CC=C7)CCN9C[C@@H](C8)C[C@](O)(C9)CC)C(OC)=O)C
• InChI: 1S/C51H72N5O10P/c1-10-47(60)27-32-28-50(46(59)64-9,40-34(19-23-55(29-32)30-47)33-17-14-15-18-37(33)52-40)36-25-35-38(26-39(36)63-8)54(7)43-49(35)21-24-56-22-16-20-48(11-2,42(49)56)44(57)51(43,61)45(58)53-41(31(5)6)67(62,65-12-3)66-13-4/h14-18,20,25-26,31-32,41-44,52,57,60-61H,10-13,19,21-24,27-30H2,1-9H3,(H,53,58)/t32-,41-,42+,43-,44-,47+,48-,49?,50+,51+/m1/s1
• InChIKey: BOELCLFVOBIXIF-FCDBPIDASA-N

Properties

• Density: 1.344g/cm³ (Cal.)