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6α-hydroxy Paclitaxel-d5

Item No. 40926

Technical Information
Formal Name
(αR,βS)-β-(benzoyl-2,3,4,5,6-d5-amino)-α-hydroxy-benzenepropanoic acid, (2aR,3S,4R,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-bis(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-3,4,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester
CAS Number
1315376-90-9
Synonyms
  • 6α-hydroxy Taxol-d5
Molecular Formula
C47H46D5NO15
Formula Weight
Purity
≥98%
A solid
DMF: SolubleDMSO: SolubleMethanol: Soluble
SMILES
C[C@]1(C([C@@H](C2=C(C)[C@@H](OC([C@H](O)[C@H](C3=CC=CC=C3)NC(C4=C([2H])C([2H])=C([2H])C([2H])=C4[2H])=O)=O)C[C@]5(O)C2(C)C)OC(C)=O)=O)[C@@]([C@@H]5OC(C6=CC=CC=C6)=O)([H])[C@@]([C@@]7([H])[C@@H](O)[C@@H]1O)(CO7)OC(C)=O
InChi Code
InChI=1S/C47H51NO15/c1-24-30(61-43(57)33(51)32(27-16-10-7-11-17-27)48-41(55)28-18-12-8-13-19-28)22-47(58)40(62-42(56)29-20-14-9-15-21-29)36-45(6,38(54)35(60-25(2)49)31(24)44(47,4)5)37(53)34(52)39-46(36,23-59-39)63-26(3)50/h7-21,30,32-37,39-40,51-53,58H,22-23H2,1-6H3,(H,48,55)/t30-,32-,33+,34-,35+,36-,37-,39+,40-,45-,46+,47+/m0/s1/i8D,12D,13D,18D,19D
InChi Key
NDCWHEDPSFRTDA-NZSUPHSRSA-N
Origin
Synthetic
Shipping & Storage Information
Storage
-20°C
Shipping
Wet ice in continental US; may vary elsewhere
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    Product Description

    6α-hydroxy Paclitaxel-d5 is intended for use as an internal standard for the quantification of 6α-hydroxy paclitaxel (Item No. 10009027) by GC- or LC-MS. 6α-hydroxy Paclitaxel is a metabolite of the antimitotic and anticancer agent paclitaxel (Item No. 10461).1 It is formed from paclitaxel by the cytochrome P450 (CYP) isoform CYP2C8.1,2

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Kumar, G.N., Oatis, J.E., Jr., Thornburg, K.R., et al6 alpha-Hydroxytaxol: Isolation and identification of the major metabolite of taxol in human liver microsomes. Drug Metab. Dispos. 22(1), 177-179 (1994).

    2. Walle, T., Kumar, G.N., McMillian, J.M., et alTaxol metabolism in rat hepatocytes. Biochem. Pharmacol. 46(9), 1661-1664 (1993).