methyl 6-[4,5-dihydroxy-2-[[7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]oxy]-6-methoxycarbonyloxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
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methyl 6-[4,5-dihydroxy-2-[[7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]oxy]-6-methoxycarbonyloxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
structure -
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CAS No:
53923-02-7
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Formula:
C29H32O17
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Chemical Name:
methyl 6-[4,5-dihydroxy-2-[[7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]oxy]-6-methoxycarbonyloxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
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Synonyms:
137 L;137-L;3,4',7-trihydroxyflavanone-3-di-D-hexuronic acid methyl ester;53923-02-7;137 L;DTXSID80968710;137-L;3,4',7-Trihydroxyflavanone-3-di-D-hexuronic acid methyl ester;3,4-Dihydro-7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2H-1-benzopyran-3-yl O-(6-methyl-D-hexuronosyl)-D-hexosiduronic acid, methyl ester;7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl methyl 2-O-(6-methylhexopyranuronosyl)hexopyranosiduronate
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CAS No:
methyl 6-[4,5-dihydroxy-2-[[7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]oxy]-6-methoxycarbonyloxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate Basic Attributes
652.6 g/mol
652.16394955 g/mol
Computed Properties
Molecular Weight:652.6
XLogP3:-0.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:9
Exact Mass:652.16394955
Monoisotopic Mass:652.16394955
Topological Polar Surface Area:257
Heavy Atom Count:46
Complexity:1080
Undefined Atom Stereocenter Count:12
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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