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CHEBI:53663 - guaiacylglycerol

Default Structure
ChEBI IDCHEBI:53663
ChEBI Nameguaiacylglycerol
Stars
DefinitionA compound made up of a guaiacyl core with an α-glyceryl substituent para to the aromatic hydroxy group.
Last Modified7 April 2017
Submitterzjosephs
DownloadsMolfile
FormulaC10H14O5
Net Charge0
Average Mass214.217
Monoisotopic Mass214.08412
SMILESCOc1cc(C(O)C(O)CO)ccc1O
InChIInChI=1S/C10H14O5/c1-15-9-4-6(2-3-7(9)12)10(14)8(13)5-11/h2-4,8,10-14H,5H2,1H3
InChIKeyLSKFUSLVUZISST-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
guaiacylglycerol (CHEBI:53663) has functional parent glycerol (CHEBI:17754)
guaiacylglycerol (CHEBI:53663) is a aromatic alcohol (CHEBI:33854)
guaiacylglycerol (CHEBI:53663) is a guaiacols (CHEBI:134251)
guaiacylglycerol (CHEBI:53663) is a tetrol (CHEBI:33573)
Incoming Relation(s)
(2E)-3-(4-{[1-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(sulfooxy)propan-2-yl]oxy}-3-methoxyphenyl)prop-2-enoic acid (CHEBI:91208) has functional parent guaiacylglycerol (CHEBI:53663)
(2E)-3-(4-{[3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-(sulfooxy)propan-2-yl]oxy}-3-methoxyphenyl)prop-2-enoic acid (CHEBI:91206) has functional parent guaiacylglycerol (CHEBI:53663)
(2E)-3-[4-({1,3-dihydroxy-1-[3-methoxy-4-(sulfooxy)phenyl]propan-2-yl}oxy)-3-methoxyphenyl]prop-2-enoic acid (CHEBI:91205) has functional parent guaiacylglycerol (CHEBI:53663)
1-(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3,5-dimethoxyphenyl)propane-1,2,3-triol (CHEBI:91183) has functional parent guaiacylglycerol (CHEBI:53663)
2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-7H-pyrano[2,3-g][1,4]benzodioxin-7-one (CHEBI:91203) has functional parent guaiacylglycerol (CHEBI:53663)
buddlenol B (CHEBI:86632) has functional parent guaiacylglycerol (CHEBI:53663)
buddlenol C (CHEBI:86635) has functional parent guaiacylglycerol (CHEBI:53663)
ficusequilignan A (CHEBI:91200) has functional parent guaiacylglycerol (CHEBI:53663)
guaiacylglycerol β-coniferyl ether (CHEBI:91172) has functional parent guaiacylglycerol (CHEBI:53663)
guaiacylglycerol β-scopoletinyl ether (CHEBI:91201) has functional parent guaiacylglycerol (CHEBI:53663)
(+)-(7S,8S)-guaiacylglycerol (CHEBI:67646) is a guaiacylglycerol (CHEBI:53663)
(−)-(7R,8S)-guaiacylglycerol (CHEBI:67645) is a guaiacylglycerol (CHEBI:53663)
IUPAC Name 
1-(4-hydroxy-3-methoxyphenyl)propane-1,2,3-triol
Synonyms  Source
1-(3-methoxy-4-hydroxyphenyl)-1,2,3-propanetriolChEBI
1-(4-hydroxy-3-methoxyphenyl)-1,2,3-propanetriolChEBI
3-(4-hydroxy-3-methoxyphenyl)-1,2,3-propanetriolChEBI
4-(1,2,3-trihydroxypropyl)-2-methoxyphenolChEBI
α-GuaiacylglycerolChemIDplus
Registry NumbersSources
Beilstein:3094344Beilstein
CAS:1208-42-0ChemIDplus