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CHEBI:44677 - N-OCTANOYLSUCROSE

Default Structure
ChEBI IDCHEBI:44677
ChEBI NameN-OCTANOYLSUCROSE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC20H36O12
Net Charge0
Average Mass468.496
Monoisotopic Mass468.22068
SMILES[H]OC([H])([H])[C@@]1(O[C@@]2([H])O[C@]([H])(C([H])([H])O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]2([H])O[H])O[C@]([H])(C([H])([H])OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])[C@@]([H])(O[H])[C@]1([H])O[H]
InChIInChI=1S/C20H36O12/c1-2-3-4-5-6-7-13(23)29-9-12-15(25)18(28)20(10-22,31-12)32-19-17(27)16(26)14(24)11(8-21)30-19/h11-12,14-19,21-22,24-28H,2-10H2,1H3/t11-,12-,14-,15-,16+,17-,18+,19-,20+/m1/s1
InChIKeyAWSYOWHJNGZJGU-OASARBKBSA-N
ChEBI Ontology
Outgoing Relation(s)
N-OCTANOYLSUCROSE (CHEBI:44677) is a unclassifieds (CHEBI:27189)
Synonyms  Source
6-O-octanoyl-beta-D-fructofuranosyl alpha-D-glucopyranosidePDBeChem
N-OCTANOYLSUCROSEPDBeChem
Manual XrefsDatabases
OSUPDBeChem