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791635-59-1

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791635-59-1 Structure

791635-59-1 Structure

Identification	Back Directory
[Name] Simotaxel
[CAS] 791635-59-1
[Synonyms] Mst 997 Simotaxel Simotaxel [usan] SLGIWUWTSWJBQE-VLCCYYTCSA-N 2-Thiophenepropanoic acid, α-hydroxy-β-[[(1-methylethoxy)carbonyl]amino]-, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-6-[(cyclopentylcarbonyl)oxy]-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2...
[Molecular Formula] C46H57NO15S
[MDL Number] MFCD13195573
[MOL File] 791635-59-1.mol
[Molecular Weight] 896.01

Chemical Properties	Back Directory
[Boiling point ] 938.7±65.0 °C(Predicted)
[density ] 1.39±0.1 g/cm3(Predicted)
[pka] 11.00±0.46(Predicted)

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[Uses] Second-line treatment of NSCLC and metastatic breast cancer.

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