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CHEBI:177390 - beta-d-glucose pentaacetate

ChEBI IDCHEBI:177390
ChEBI Namebeta-d-glucose pentaacetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O11
Net Charge0
Average Mass390.341
Monoisotopic Mass390.11621
SMILESCC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
InChIInChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1
InChIKeyLPTITAGPBXDDGR-IBEHDNSVSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
beta-d-glucose pentaacetate (CHEBI:177390) has functional parent hexacarboxylic acid (CHEBI:59359)
beta-d-glucose pentaacetate (CHEBI:177390) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
[(2R,3R,4S,5R,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate
Manual XrefsDatabases
2006823ChemSpider
HMDB0034223HMDB
Registry NumbersSources
CAS:604-69-3ChemIDplus