 Home > Encyclopedia > 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one

1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one

1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one structure

CAS No:
65520-51-6
Formula:
C27H34O15
Chemical Name:
1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one
Synonyms:
65520-51-6;Neoeriocitrin dihydrochalcone;SCHEMBL20437866;DTXSID00984119;1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one;1-Propanone, 1-(4-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(3,4-dihydroxyphenyl)-;4-[3-(3,4-Dihydroxyphenyl)propanoyl]-3,5-dihydroxyphenyl 2-O-(6-deoxyhexopyranosyl)hexopyranoside

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1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one Basic Attributes

Molecular Weight：

598.5 g/mol

Exact Mass：

598.18977037 g/mol

Characteristics

PSA：

256 Å²

Computed Properties

Molecular Weight:598.5
XLogP3:-0.6
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:9
Exact Mass:598.18977037
Monoisotopic Mass:598.18977037
Topological Polar Surface Area:256
Heavy Atom Count:42
Complexity:867
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: levasole; magnesium pyrophosphate formula; 1 bromopropane; h2cro4; pbso4; quinone

Guide of 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3,4-dihydroxyphenyl)propan-1-one

Basic Attributes
Characteristics
Computed Properties

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