(6-hydroxy-7-methoxy-4-oxo-2-phenylchromen-5-yl) (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
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![(6-hydroxy-7-methoxy-4-oxo-2-phenylchromen-5-yl) (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c3af1e50b623459bb42e9a9f5a7b937e.png "(6-hydroxy-7-methoxy-4-oxo-2-phenylchromen-5-yl) (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate")
(6-hydroxy-7-methoxy-4-oxo-2-phenylchromen-5-yl) (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
structure -
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CAS No:
29324-80-9
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Formula:
C28H30O16
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Chemical Name:
(6-hydroxy-7-methoxy-4-oxo-2-phenylchromen-5-yl) (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
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Synonyms:
29324-80-9;Palustrin;DTXSID00951881;Hexopyranosyl 6-hydroxy-7-methoxy-4-oxo-2-phenyl-4H-1-benzopyran-5-yl hexopyranosiduronate;beta-D-Glucopyranosiduronic acid, 6-hydroxy-7-methoxy-4-oxo-2-phenyl-4H-1-benzopyran-5-yl O-beta-D-glucopyranosyl-
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CAS No:
(6-hydroxy-7-methoxy-4-oxo-2-phenylchromen-5-yl) (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate Basic Attributes
622.5 g/mol
622.15338487 g/mol
Computed Properties
Molecular Weight:622.5
XLogP3:-1.2
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:8
Exact Mass:622.15338487
Monoisotopic Mass:622.15338487
Topological Polar Surface Area:251
Heavy Atom Count:44
Complexity:1050
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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