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CHEBI:167952 - Isopentyl gentiobioside

ChEBI IDCHEBI:167952
ChEBI NameIsopentyl gentiobioside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H32O11
Net Charge0
Average Mass412.432
Monoisotopic Mass412.19446
SMILESCC(C)CCOC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C17H32O11/c1-7(2)3-4-25-16-14(23)13(22)11(20)9(28-16)6-26-17-15(24)12(21)10(19)8(5-18)27-17/h7-24H,3-6H2,1-2H3
InChIKeyPPIXDGFHKZNFOD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Isopentyl gentiobioside (CHEBI:167952) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(3-methylbutoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0041512HMDB