CHEBI:155892 - tremuloidin

ChEBI IDCHEBI:155892
ChEBI Nametremuloidin
Stars
DefinitionAn aryl β-D-glucoside that is salicin in which the hydrogen of the 2-hydroxy group is replaced by a benzoyl group. It is found in the leaves and bark of willows and poplars.
Last Modified19 June 2020
Submittermwilliams
DownloadsMolfile
FormulaC20H22O8
Net Charge0
Average Mass390.388
Monoisotopic Mass390.13147
SMILESO=C(O[C@H]1[C@H](Oc2ccccc2CO)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccccc1
InChIInChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)26-20-18(17(24)16(23)15(11-22)27-20)28-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1
InChIKeyFWPNCAYVELBDRB-BFMVXSJESA-N
Species of MetaboliteComponentSourceComments
Homalium cochinchinense (ncbitaxon:1009479) bark (BTO:0001301) PubMed (15104498) Isolated from root bark.
Salix tetrasperma (ncbitaxon:75722) leaf (BTO:0000713) PubMed (23016273)
Populus alba (ncbitaxon:43335) - PubMed (31137712)
Salix acutifolia (ncbitaxon:1233969) stem (BTO:0001300) PubMed (26820172)
Populus tomentosa (ncbitaxon:118781) bark (BTO:0001301) PubMed (22860454) Isolated from stem bark.
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
tremuloidin (CHEBI:155892) has functional parent salicin (CHEBI:17814)
tremuloidin (CHEBI:155892) has role plant metabolite (CHEBI:76924)
tremuloidin (CHEBI:155892) is a aromatic primary alcohol (CHEBI:33857)
tremuloidin (CHEBI:155892) is a aryl β-D-glucoside (CHEBI:28749)
tremuloidin (CHEBI:155892) is a benzoate ester (CHEBI:36054)
tremuloidin (CHEBI:155892) is a benzyl alcohols (CHEBI:22743)
tremuloidin (CHEBI:155892) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name 
2-(hydroxymethyl)phenyl 2-O-benzoyl-β-D-glucopyranoside
Synonyms  Source
2'-benzoylsalicinChEBI
2'-O-benzoylsalicinChEBI
Manual XrefsDatabases
C00043991KNApSAcK
Registry NumbersSources
CAS:529-66-8ChemIDplus
Citations