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CAS 78432-78-7

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(1beta,2alpha,5beta,7beta,10beta,13beta)-4,10-bis(acetyloxy)-1,7,13,19-tetrahydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate

Description:
The chemical substance with the name "(1beta,2alpha,5beta,7beta,10beta,13beta)-4,10-bis(acetyloxy)-1,7,13,19-tetrahydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate" and CAS number "78432-78-7" is a complex organic compound belonging to the taxane family, which is known for its significant biological activity, particularly in cancer treatment. This compound features multiple hydroxyl groups, which contribute to its solubility and reactivity, as well as acetoxy groups that enhance its pharmacological properties. The presence of an epoxide and a ketone functional group indicates potential reactivity, making it a candidate for various chemical transformations. Its structural complexity suggests that it may exhibit unique interactions with biological targets, potentially influencing cell division and apoptosis. The benzoate moiety may also play a role in modulating its biological activity and pharmacokinetics. Overall, this compound exemplifies the intricate relationship between structure and function in medicinal chemistry, particularly in the development of therapeutic agents.
Formula:C31H38O12
InChI:InChI=1/C31H38O12/c1-15-19(35)12-31(39)26(42-27(38)18-9-7-6-8-10-18)24-29(13-32,20(36)11-21-30(24,14-40-21)43-17(3)34)25(37)23(41-16(2)33)22(15)28(31,4)5/h6-10,19-21,23-24,26,32,35-36,39H,11-14H2,1-5H3/t19-,20+,21-,23-,24+,26+,29-,30+,31+/m1/s1
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