 Home > Encyclopedia > 8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-, (2R,8R,14R)-

8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-, (2R,8R,14R)-

8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-, (2R,8R,14R)- structure

CAS No:
176739-80-3
Formula:
C36H32O15
Chemical Name:
8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-, (2R,8R,14R)-
Synonyms:
8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one,8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-,(2R,8R,14R)-;8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one,8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-,[2R-(2α,8β,14α)]-;Diinsinin

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8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-, (2R,8R,14R)- Basic Attributes

Molecular Weight：

704.6 g/mol

Exact Mass：

704.63

Characteristics

PSA：

245 Å²

Melting Point：

223-224 °C (decomp)

Computed Properties

Molecular Weight:704.6
XLogP3:2.5
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:5
Exact Mass:704.17412031
Monoisotopic Mass:704.17412031
Topological Polar Surface Area:245
Heavy Atom Count:51
Complexity:1250
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 2,8-bis(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-, (2R,8R,14R)-

176739-79-0

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Guide of 8,14-Methano-4H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-4-one, 8-(3,4-dihydroxyphenyl)-11-(β-D-glucopyranosyloxy)-2,3-dihydro-5,13-dihydroxy-2-(4-hydroxyphenyl)-, (2R,8R,14R)-

Basic Attributes
Characteristics
Computed Properties
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