(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxyoxane-2-carboxylic acid
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![(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxyoxane-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f39d30c2f85848848812358ce697c35a.png "(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxyoxane-2-carboxylic acid")
(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxyoxane-2-carboxylic acid
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CAS No:
128095-54-5
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Formula:
C16H13F3O9
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Chemical Name:
(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxyoxane-2-carboxylic acid
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Synonyms:
4-TFMU;4-trifluoromethylumbelliferyl iduronide;4-trifluoromethylumbelliferyl-alpha-L-iduronide;128095-54-5;4-Tfmu;4-Trifluoromethylumbelliferyl iduronide;4-Trifluoromethylumbelliferyl-alpha-L-iduronide;DTXSID50926069;2-Oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl hexopyranosiduronic acid
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CAS No:
(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-oxo-4-(trifluoromethyl)chromen-7-yl]oxyoxane-2-carboxylic acid Basic Attributes
406.26 g/mol
406.05116647 g/mol
Computed Properties
Molecular Weight:406.26
XLogP3:0.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:3
Exact Mass:406.05116647
Monoisotopic Mass:406.05116647
Topological Polar Surface Area:143
Heavy Atom Count:28
Complexity:664
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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