Docetaxel-d6 Metabolites M1 and M3 (Mixture of Diastereomers)

CAS: 157067-33-9 157183-03-4

Ref. TR-D494407

Informação sobre produto

• Nome: Docetaxel-d6 Metabolites M1 and M3 (Mixture of Diastereomers)
• Sinónimos: RPR 111026-d6
• CAS: 157067-33-9 157183-03-4

Descrição

Applications The major labelled metabolites 1 and 3 (diastereomers) of Docetaxel (D494420).
References Van Asperen, J., et al.: J. Pharm. Sci., 86, 881 (1997), Bradshaw, D.M., et al.: J. Clin. Oncol., 16, 3674 (1998),

• Marca: TRC

Propriedades químicas

• Peso molecular: 827.9
• Fórmula: C₄₃H₄₅D₆NO₁₅
• Cor/forma: Neat
• InChI: InChI=1S/C43H51NO15/c1-21-25(56-36(51)31(48)29(23-14-10-8-11-15-23)44-37(52)40(5,6)59-38(44)53)19-43(54)34(57-35(50)24-16-12-9-13-17-24)32-41(7,33(49)30(47)28(21)39(43,3)4)26(46)18-27-42(32,20-55-27)58-22(2)45/h8-17,25-27,29-32,34,37,46-48,52,54H,18-20H2,1-7H3/t25-,26-,27+,29?,30+,31+,32-,34-,37?,41?,42-,43+/m0/s1/i5D3,6D3
• Chave InChI: InChIKey=MZGHWPNTSVYFCV-BCDPAOBNSA-N
• SMILES: [2H]C([2H])([2H])C1(C([2H])([2H])[2H])OC(=O)N(C(c2ccccc2)[C@@H](O)C(=O)O[C@H]2CC3(O)[C@@H](OC(=O)c4ccccc4)[C@H]4[C@](C)(C(=O)[C@H](O)C(=C2C)C3(C)C)[C@@H](O)C[C@H]2OC[C@]24OC(C)=O)C1O