1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-, (5R,6S)-
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![1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-, (5R,6S)- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c241d7cddea44eee9f2e47f917f27eee.png "1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-, (5R,6S)-")
1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-, (5R,6S)-
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CAS No:
11019-08-2
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Formula:
C24H28O13
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Chemical Name:
1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-, (5R,6S)-
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Synonyms:
1H,3H-Pyrano[3,4-c]pyran-1-one,5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-,(5R,6S)-;1H,3H-Pyrano[3,4-c]pyran-1-one,5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-,(5R-trans)-;Gentiopicrin,tetraacetate;Gentiopicroside tetraacetate;Tetraacetyl gentiopicroside;101673-45-4;1329-36-8;17388-41-9
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CAS No:
1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-5,6-dihydro-6-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]-, (5R,6S)- Basic Attributes
524.5 g/mol
524.47
234-250-9
Computed Properties
Molecular Weight:524.5
XLogP3:0.5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:12
Exact Mass:524.15299094
Monoisotopic Mass:524.15299094
Topological Polar Surface Area:159
Heavy Atom Count:37
Complexity:1010
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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