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CAS 133524-69-3: Benzenepropanoic acid, β-amino-α-hydroxy-, (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-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (αR,βS)-

Formula:C38H45NO12
InChI:InChI=1S/C38H45NO12/c1-19-23(49-34(46)29(43)27(39)21-12-8-6-9-13-21)17-38(47)32(50-33(45)22-14-10-7-11-15-22)30-36(5,31(44)28(42)26(19)35(38,3)4)24(41)16-25-37(30,18-48-25)51-20(2)40/h6-15,23-25,27-30,32,41-43,47H,16-18,39H2,1-5H3/t23-,24-,25+,27-,28+,29+,30-,32-,36+,37-,38+/m0/s1
InChI key:InChIKey=QCOGLDHTESFSPY-BFLUDPMCSA-N
SMILES:O(C(C)=O)[C@]12[C@]3([C@H](OC(=O)C4=CC=CC=C4)[C@@]5(O)C(C)(C)C([C@@H](O)C(=O)[C@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](OC([C@@H]([C@@H](N)C6=CC=CC=C6)O)=O)C5)[H]
Synonyms:
  • Benzenepropanoic acid, β-amino-α-hydroxy-, (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-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (αR,βS)-
  • Benzenepropanoic acid, β-amino-α-hydroxy-, 12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, [2aR-[2aα,4β,4aβ,6β,9α(αR*,βS*),11α,12α,12aα,12bα]]-
  • 7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete, benzenepropanoic acid deriv.
  • 10-Desacetyl-N-debenzoylpaclitaxel
  • 10-Deacetylbaccatin III 13-[β(S)-amino-α(R)-hydroxyphenylpropionate]
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Found 4 products.
  • N-Desboc docetaxel-d5

    CAS:
    N-Desboc docetaxel-d5 is a deuterated analog of the chemotherapy drug docetaxel, which is derived from the diterpenoid taxane with a substitution at isotopic positions. This compound is synthesized to enhance the stability and traceability of docetaxel in biological systems during pharmacokinetic and metabolic studies. Its mode of action involves the inhibition of microtubule depolymerization, thus disrupting cell division and leading to apoptosis in rapidly dividing cancer cells. Applications of N-Desboc docetaxel-d5 are primarily within the realm of drug metabolism and pharmacokinetic research. By incorporating deuterium atoms, researchers can more accurately track and quantify the distribution and breakdown of the docetaxel molecule in vivo and in vitro. Such studies are crucial in understanding the pharmacological profile and metabolic pathways of docetaxel, facilitating the optimization of dosing regimens and the development of novel therapeutic strategies. Its utilization is a testament to the innovative approaches in drug development and cancer research, pushing the boundaries of precision medicine.
    Formula:C38H45NO12
    Purity:Min. 95%
    Molecular weight:707.8 g/mol

    Ref: 3D-IFA52469

    1mg
    242.00€
    2mg
    355.00€
    5mg
    506.00€
    10mg
    839.00€
    25mg
    1,581.00€
  • N-DesBoc Docetaxel

    Controlled Product
    CAS:
    Applications N-DesBoc Docetaxel is an impurity in the synthesis of Docetaxel (D494420), a semisynthetic derivative of Paclitaxel. An antimitotic agent that promotes the assembly of micro-tubules and inhibits their de-polymerization to free tubulin. An antine oplastic. References Ringel, I., et al.: J. Natl. Cancer Inst., 83, 288 (1991), Extra, J.-M., et al.: Cancer Res., 53, 1037 (1993)
    Formula:C38H45NO12
    Color and Shape:Neat
    Molecular weight:707.77

    Ref: TR-D289235

    5mg
    262.00€
    50mg
    1,749.00€
  • N-DesBoc Docetaxel-d5

    Controlled Product
    CAS:
    Formula:C38D5H40NO12
    Color and Shape:Neat
    Molecular weight:712.794

    Ref: TR-D289237

    100mg
    5,893.00€
  • Docetaxel Impurity 11

    CAS:
    Formula:C38H45NO12
    Color and Shape:White To Off-White Solid
    Molecular weight:707.77

    Ref: 4Z-D-1933

    5mg
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    10mg
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    25mg
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    50mg
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    100mg
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