Paclitaxel-d5

• CAT Number: R003497
• CAS Number: 1129540-33-5
• Molecular Formula: C47H51NO14
• Molecular Weight: 858.949
• Purity: ≥95%
• Synonyms: Abraxane-d5; Genaxol-d5; Genetaxyl-d5; OncoGel-d5; Onxal-d5; Pacliex-d5; (-)-Paclitaxel-d5; Taxol-d5; Yewtaxan-d5; NSC 125973-d5
• Target: Cytoskeleton
• Storage: -20°C
• IUPAC Name: [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-1,9-dihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2,3,4,5,6-pentadeuteriobenzoyl)amino]-3-phenylpropanoyl]oxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
• InChI: InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1/i8D,12D,13D,18D,19D
• InChIKey: RCINICONZNJXQF-JQTCHTAZSA-N
• SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)N[C@@H](C2=CC=CC=C2)[C@H](C(=O)O[C@H]3C[C@]4([C@H]([C@H]5[C@@]([C@H](C[C@@H]6[C@]5(CO6)OC(=O)C)O)(C(=O)[C@@H](C(=C3C)C4(C)C)OC(=O)C)C)OC(=O)C7=CC=CC=C7)O)O)[2H])[2H]

Paclitaxel-d5 is a deuterated form of the chemotherapy drug paclitaxel, where five hydrogen atoms are replaced with deuterium. This isotopically labeled compound is essential for research in cancer pharmacology, particularly in studying the drug’s metabolism, pharmacokinetics, and mechanism of action. The deuterium atoms provide a unique mass signature, allowing for precise tracking and quantification in mass spectrometry studies. Paclitaxel-d5 is used to investigate the metabolic pathways of paclitaxel in cancer treatment, helping researchers understand its efficacy, potential side effects, and interactions with other drugs. This compound is crucial for advancing cancer therapy and optimizing treatment protocols.