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7-Epitaxol

7-Epitaxol

CAS: 105454-04-4

Molecular Formula: C47H51NO14

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7-Epitaxol - Names and Identifiers

Name 7-Epitaxol
Synonyms Epitaxol
7-Epitaxol
7-epi-Taxol
7-Epipaclitaxel
7-epi-Paclitaxel
7,11-Methano-1H-c
7-Epitaxol 7-Epipaclitaxel
7-epi-Paclitaxel(7-Epitaxol)
7-Epipaclitaxel, froM Taxus chinensis
(2alpha,5beta,7alpha,10beta,13alpha)-4,10-bis(acetyloxy)-13-{[(2R,3S)-3-(benzoylamino)-2-hydroxy-3-phenylpropanoyl]oxy}-1,7-dihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate
Benzenepropanoicacid,beta-(benzoylaMino)-alpha-hydroxy-,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-ylester,(2ar-(
Benzenepropanoic acid, beta-(benzoylamino)-alpha-hydroxy-, (2ar,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-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, (alphar,betas)-
Benzenepropanoic acid, beta-(benzoylamino)-alpha-hydroxy-, (2aR,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-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, (alphaR,betaS)-
Benzenepropanoic acid, beta-(benzoylamino)-alpha-hydroxy-, 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, (2ar- (2aalpha,4alpha,4abeta,6beta,9alpha(alphar*,betas*),11alpha,12alpha,12aalpha,12balpha))-
Benzenepropanoic acid, beta-(benzoylamino)-alpha-hydroxy-, 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, (2aR- (2aalpha,4alpha,4abeta,6beta,9alpha(alphaR*,betaS*),11alpha,12alpha,12aalpha,12balpha))-
CAS 105454-04-4
InChI InChI=1/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32+,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1

7-Epitaxol - Physico-chemical Properties

Molecular FormulaC47H51NO14
Molar Mass853.91
Density1.39±0.1 g/cm3 (20 ºC 760 Torr)
Melting Point168-170?C
Boling Point957.1±65.0 °C(Predicted)
Specific Rotation(α)-32.3 (c, 0.012 in MeOH)
Flash Point532.6°C
Solubility Soluble in ethanol, acetone, ether, benzene and other organic solvents
Vapor Presure0mmHg at 25°C
AppearanceWhite crystal
pKa11.90±0.20(Predicted)
Storage ConditionInert atmosphere,2-8°C
Refractive Index1.637
MDLMFCD07783713
Physical and Chemical PropertiesWhite crystal, soluble in methanol, ethanol, DMSO and other organic solvents, derived from yew.
In vitro study 7-epi-Taxol (7-Epitaxol) is a metabolite of taxol. 7-epi-Taxol has activity comparable to that of taxol on cell replication, microtubule bundle formation and in vitro microtubule polymerization.

7-Epitaxol - Risk and Safety

HS Code29329990

7-Epitaxol - Reference

Reference
Show more
1. Chen Ran, Li Xing, Jiang Feng, et al. Simultaneous Determination of Five Taxanes in Preparation Wine by High Performance Liquid Chromatography-Tandem Mass Spectrometry [J]. Food Industry Science and Technology, 2019, 040(022):254-258.
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7-Epitaxol
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