7,10-O-Bis{[(2,2,2,-trichloroethyl)oxy]carbonyl} Docetaxel-d9

CAS: 114915-14-9

Ref. TR-B693542

Product Information

• Name: 7,10-O-Bis{[(2,2,2,-trichloroethyl)oxy]carbonyl} Docetaxel-d9
• Synonyms: (alphaR,betaS)-beta-[[(1,1-dimethylethoxy)carbonyl]amino]-alpha-hydroxybenzenepropanoic Acid (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-11-hydroxy-4a,8,13,13-tetramethyl-5-oxo-4,6-bis[[(2,2,2-trichloroethoxy)carbonyl]oxy]-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl Ester, Intermediate For Docetaxel, Intermediateiiifordocetaxel, Intermediateofdocetaxel, N-1 Step intermediate, (aR,bS)-beta-[[(1,1-Dimethylethoxy)carbonyl]amino]-alpha-hydroxy-benzenepropanoic acid, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-11-hydroxy-4a,8,13,13-tetramethyl-5-oxo-4,6-bis[[(2,2,2-trichloroethoxy)carbonyl]oxy]-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (2alpha,5beta,7beta,10beta,13alpha)-4-(acetyloxy)-13-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-3-phenylpropanoyl}oxy)-1-hydroxy-9-oxo-7,10-bis{[(2,2,2-trichloroethoxy)carbonyl]oxy}-5,20-epoxytax-11-en-2-yl benzoate, 7,10-O-Ditroc docetaxel, 7,10-Ditroc Docetaxel, 7,10-di-Troc-Docetaxel

Description

Applications Labelled Docetaxel derivative as antitumor agent.
References Ojima, I., et al.: Bioorg. Med. Chem., 8, 1619 (2000),

• Brand: TRC

Chemical properties

• Molecular weight: 1167.73
• Formula: C₄₉D₉H₄₆Cl₆NO₁₈
• Color/Form: Neat
• InChI: InChI=1S/C49H55Cl6NO18/c1-24-28(69-39(61)33(58)32(26-15-11-9-12-16-26)56-40(62)74-43(3,4)5)20-47(65)37(72-38(60)27-17-13-10-14-18-27)35-45(8,36(59)34(31(24)44(47,6)7)71-42(64)68-23-49(53,54)55)29(70-41(63)67-22-48(50,51)52)19-30-46(35,21-66-30)73-25(2)57/h9-18,28-30,32-35,37,58,65H,19-23H2,1-8H3,(H,56,62)/t28-,29-,30+,32-,33+,34+,35-,37-,45+,46-,47?/m0/s1/i3D3,4D3,5D3
• InChI key: InChIKey=QTCVMFMWHTVJTQ-VUGCVDSASA-N
• SMILES: [2H]C([2H])([2H])C(OC(=O)N[C@@H](c1ccccc1)[C@@H](O)C(=O)O[C@H]1CC2(O)[C@@H](OC(=O)c3ccccc3)[C@H]3[C@](C)(C(=O)[C@H](OC(=O)OCC(Cl)(Cl)Cl)C(=C1C)C2(C)C)[C@@H](OC(=O)OCC(Cl)(Cl)Cl)C[C@H]1OC[C@]13OC(C)=O)(C([2H])([2H])[2H])C([2H])([2H])[2H]