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117229-54-6

117229-54-6 structure
117229-54-6 structure
  • Name: Taxacin
  • Chemical Name: (1S,3aR,4R,5R,5aR,7S,9S,9aR,10R,11S,11aR)-9a-((benzoyloxy)methyl)-7-(cinnamoyloxy)-11a-hydroxy-1,3a-dimethyl-6-methylene-13-oxotetradecahydro-1,4-ethanobenzo[5,6]cycloocta[1,2-c]furan-5,9,10,11-tetrayl tetraacetate
  • CAS Number: 117229-54-6
  • Molecular Formula: C44H48O15
  • Molecular Weight: 816.84
  • Catalog: Natural product Moss
  • Create Date: 2017-09-15 09:19:01
  • Modify Date: 2024-03-02 15:22:25
  • Taxacin is a natural product, that can be isolated from seeds of Yew[1].

Name (1S,3aR,4R,5R,5aR,7S,9S,9aR,10R,11S,11aR)-9a-((benzoyloxy)methyl)-7-(cinnamoyloxy)-11a-hydroxy-1,3a-dimethyl-6-methylene-13-oxotetradecahydro-1,4-ethanobenzo[5,6]cycloocta[1,2-c]furan-5,9,10,11-tetrayl tetraacetate
Synonyms (2α,5α,7β,9α,10β,12α)-2,7,9,10-Tetraacetoxy-11-hydroxy-13-oxo-5-{[(2E)-3-phenyl-2-propenoyl]oxy}-12,17-epoxytax-4(20)-en-19-yl benzoate
2-Propenoic acid, 3-phenyl-, (1S,3aR,4R,5R,5aR,7S,9S,9aR,10R,11S,11aR)-5,9,10,11-tetrakis(acetyloxy)-9a-[(benzoyloxy)methyl]tetradecahydro-11a-hydroxy-1,3a-dimethyl-6-methylene-13-oxo-1,4-ethanobenzo[5,6]cycloocta[1,2-c]furan-7-yl ester, (2E)-
(2α,5α,7β,9α,10β,12α)-2,7,9,10-tetrakis(acetyloxy)-11-hydroxy-13-oxo-5-{[(2E)-3-phenylprop-2-enoyl]oxy}-12,17-epoxytax-4(20)-en-19-yl benzoate
Density 1.4±0.1 g/cm3
Boiling Point 830.6±65.0 °C at 760 mmHg
Molecular Formula C44H48O15
Molecular Weight 816.84
Flash Point 241.9±27.8 °C
Exact Mass 816.299316
PSA 204.33000
LogP 6.04
Vapour Pressure 0.0±3.2 mmHg at 25°C
Index of Refraction 1.597
Hazard Codes Xi
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