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CHEBI:167927 - Glucosyl (E)-2,6-Dimethyl-2,5-heptadienoate

ChEBI IDCHEBI:167927
ChEBI NameGlucosyl (E)-2,6-Dimethyl-2,5-heptadienoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O7
Net Charge0
Average Mass316.350
Monoisotopic Mass316.15220
SMILESCC(C)=CC/C=C(\C)C(=O)OC1OC(CO)C(O)C(O)C1O
WURCSWURCS=2.0/1,1,0/[axxxxh-1x_1-5_1*OCC=^ECCC=CC/8C/4C/3=O]/1/
InChIInChI=1S/C15H24O7/c1-8(2)5-4-6-9(3)14(20)22-15-13(19)12(18)11(17)10(7-16)21-15/h5-6,10-13,15-19H,4,7H2,1-3H3/b9-6+
InChIKeyBHPXBBXWEPCSOK-RMKNXTFCSA-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)
Glucosyl (E)-2,6-Dimethyl-2,5-heptadienoate (CHEBI:167927) is a hexose (CHEBI:18133)
IUPAC Name 
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2E)-2,6-dimethylhepta-2,5-dienoate
Manual XrefsDatabases
HMDB0035136HMDB