[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methyl octanoate
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[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methyl octanoate
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CAS No:
136152-82-4
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Formula:
C20H36O12
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Chemical Name:
[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methyl octanoate
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Synonyms:
6-o-Capryloylsucrose;UNII-NA2JF794IZ;NA2JF794IZ;alpha-D-Glucopyranoside, 6-O-(1-oxooctyl)-beta-D-fructofuranosyl;Sucrose 6-o-octanoate;6-o-Capryloylsucrose, (+)-;136152-82-4;DB03190;Q27284754;6-O-Octanoyl-beta-D-fructofuranosyl alpha-D-glucopyranoside;UNII-7MUS7RP47D component AWSYOWHJNGZJGU-OASARBKBSA-N
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CAS No:
[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methyl octanoate Basic Attributes
468.5 g/mol
468.22067658 g/mol
NA2JF794IZ
Computed Properties
Molecular Weight:468.5
XLogP3:-0.7
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:13
Exact Mass:468.22067658
Monoisotopic Mass:468.22067658
Topological Polar Surface Area:196
Heavy Atom Count:32
Complexity:577
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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