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153415-45-3

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153415-45-3 Structure

153415-45-3 Structure
IdentificationBack Directory
[Name]

PACLITAXEL C
[CAS]

153415-45-3
[Synonyms]

TAXOL C
PACLITAXEL C
Taxuyunnanine
Taxuyunnanine A
(-)-Taxuyunnanine
Paclitaxel EP IMpurity C
N-Debenzoyl-N-hexanoylpaclitaxel
Paclitaxel Impurity 3（Paclitaxel EP Impurity C）
Paclitaxel EP Impurity C N-debenzoyl-N-hexanoylpaclitaxel (paclitaxel C),
Paclitaxel impurity 9/Paclitaxel EP Impurity C/N-Debenzoyl-N-hexanoylpaclitaxel/(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-9-(((2R,3S)-3-hexanamido-2-hydroxy-3-phenylpropanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,1
(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-9-(((2R,3S)-3-hexanamido-2-hydroxy-3-phenylpropanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl d
(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-9-(((2R,3S)-3-hexanamido-2-hydroxy-3-phenylpropanoyl)oxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate
Benzenepropanoic acid, α-hydroxy-β-[(1-oxohexyl)amino]-, (2aR,4S,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-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (αR,βS)-
[Molecular Formula]

C46H57NO14
[MDL Number]

MFCD00934688
[MOL File]

153415-45-3.mol
[Molecular Weight]

847.94
Chemical PropertiesBack Directory
[Boiling point ]

932.3±65.0 °C(Predicted)
[density ]

1.34±0.1 g/cm3 (20 ºC 760 Torr)
[storage temp. ]

-20°C
[solubility ]

Methanol: soluble
[form ]

neat
[pka]

11.93±0.20(Predicted)
[Major Application]

pharmaceutical (small molecule)
[InChIKey]

BEHTXUBGUDGCNQ-IEAAAIHOSA-N
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)Skull and Crossbones (GHS06)
GHS08,GHS06
[Signal word ]

Danger
[Hazard statements ]

H340-H351-H372-H301-H360
[Precautionary statements ]

P264-P270-P301+P310-P321-P330-P405-P501-P201-P202-P281-P308+P313-P405-P501-P260-P264-P270-P314-P501
Hazard InformationBack Directory
[Uses]

Paclitaxel related compound C. Paclitaxel analogs were tested for tubulin assembly and cytotoxicity, and were shown to retain potency similar to Paclitaxel.
Spectrum DetailBack Directory
[Spectrum Detail]

PACLITAXEL C(153415-45-3)1HNMR
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