5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione
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![5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/18899fa32d6e44aab98b14122a2f83a8.png "5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione")
5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione
structure -
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CAS No:
69093-97-6
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Formula:
C17H28N2O8
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Chemical Name:
5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione
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Synonyms:
1-(beta-D-glucopyranosyl)amobarbital;1-(beta-D-Glucopyranosyl)amobarbital;69093-97-6;DTXSID20219132;5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione;5-Ethyl-1-beta-D-glucopyranosyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
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CAS No:
5-ethyl-5-(3-methylbutyl)-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione Basic Attributes
388.4 g/mol
388.18456586 g/mol
DTXSID20219132
Computed Properties
Molecular Weight:388.4
XLogP3:-0.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:388.18456586
Monoisotopic Mass:388.18456586
Topological Polar Surface Area:157
Heavy Atom Count:27
Complexity:598
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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