Identification |
Name: | (2alpha,5beta,7alpha,10beta,13alpha)-4,10-bis(acetyloxy)-1,7-dihydroxy-13-({(2R,3S)-2-hydroxy-3-[(2-methylbutanoyl)amino]-3-phenylpropanoyl}oxy)-9-oxo-5,20-epoxytax-11-en-2-yl benzoate |
Synonyms: | Taxoline;AC1L4BS9;CHEMBL412193;213539-42-5;Benzenepropanoic acid, alpha-hydroxy-beta-((2-methyl-1-oxobutyl)amino)-, (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)- |
CAS: | 213539-42-5 |
Molecular Formula: | C45H55NO14 |
Molecular Weight: | 833.9165 |
InChI: | InChI=1/C45H55NO14/c1-9-23(2)39(52)46-33(27-16-12-10-13-17-27)34(50)41(54)58-29-21-45(55)38(59-40(53)28-18-14-11-15-19-28)36-43(8,30(49)20-31-44(36,22-56-31)60-26(5)48)37(51)35(57-25(4)47)32(24(29)3)42(45,6)7/h10-19,23,29-31,33-36,38,49-50,55H,9,20-22H2,1-8H3,(H,46,52)/t23?,29-,30+,31+,33-,34+,35+,36-,38-,43+,44-,45+/m0/s1 |
Molecular Structure: |
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Properties |
Flash Point: | 511.8°C |
Boiling Point: | 922.6°C at 760 mmHg |
Density: | 1.35g/cm3 |
Refractive index: | 1.606 |
Flash Point: | 511.8°C |
Safety Data |
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