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CHEBI:171872 - 2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 1-glucoside

ChEBI IDCHEBI:171872
ChEBI Name2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 1-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H30O10
Net Charge0
Average Mass418.439
Monoisotopic Mass418.18390
SMILESCOc1cc(CCCO)ccc1OC(CO)COC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C19H30O10/c1-26-14-7-11(3-2-6-20)4-5-13(14)28-12(8-21)10-27-19-18(25)17(24)16(23)15(9-22)29-19/h4-5,7,12,15-25H,2-3,6,8-10H2,1H3
InChIKeyLRRKTNFBBSNZEN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 1-glucoside (CHEBI:171872) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[3-hydroxy-2-[4-(3-hydroxypropyl)-2-methoxyphenoxy]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0040353HMDB