(2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal
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![(2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cd1d38c2bdb7415f91a5115e982a218e.png "(2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal")
(2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal
structure -
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CAS No:
69682-31-1
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Formula:
C26H28O14
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Chemical Name:
(2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal
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Synonyms:
69682-31-1;DTXSID80989844;D-Glucose, O-(9,10-dihydro-4-hydroxy-3-(hydroxymethyl)-9,10-dioxo-2-anthracenyl)-6-O-beta-D-xylopyranosyl-;2-O-[4-Hydroxy-3-(hydroxymethyl)-9,10-dioxo-9,10-dihydroanthracen-2-yl]-6-O-pentopyranosylhexose
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CAS No:
(2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal Basic Attributes
564.5 g/mol
564.14790556 g/mol
Computed Properties
Molecular Weight:564.5
XLogP3:-2.4
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:10
Exact Mass:564.14790556
Monoisotopic Mass:564.14790556
Topological Polar Surface Area:241
Heavy Atom Count:40
Complexity:901
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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