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CHEBI:70193 - (7R)-7-hydroxytaxiresinol

ChEBI IDCHEBI:70193
ChEBI Name(7R)-7-hydroxytaxiresinol
Stars
ASCII Name(7R)-7-hydroxytaxiresinol
DefinitionA lignan that consists of tetrahydrofuran substituted by a 3,4-dihydroxyphenyl group at position 2, a hydroxymethyl group at position 3 and a hydroxy(4-hydroxy-3-methoxyphenyl)methyl group at position 4. It has been isolated from Taxus yunnanensis.
Last Modified7 April 2017
DownloadsMolfile
FormulaC19H22O7
Net Charge0
Average Mass362.378
Monoisotopic Mass362.13655
SMILES[H][C@]1([C@@H](O)c2ccc(O)c(OC)c2)CO[C@H](c2ccc(O)c(O)c2)[C@H]1CO
InChIInChI=1S/C19H22O7/c1-25-17-7-10(2-5-15(17)22)18(24)13-9-26-19(12(13)8-20)11-3-4-14(21)16(23)6-11/h2-7,12-13,18-24H,8-9H2,1H3/t12-,13-,18-,19+/m0/s1
InChIKeyPMALFGMVFUCPMK-BIPCEHGGSA-N
Species of MetaboliteComponentSourceComments
Taxus yunnanensis (ncbitaxon:147275) xylem (BTO:0001468) PubMed (21138310) Previous component: wood; Aqueous extract of air-dried, powdered wood
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)
(7R)-7-hydroxytaxiresinol (CHEBI:70193) has role plant metabolite (CHEBI:76924)
(7R)-7-hydroxytaxiresinol (CHEBI:70193) is a guaiacols (CHEBI:134251)
(7R)-7-hydroxytaxiresinol (CHEBI:70193) is a lignan (CHEBI:25036)
(7R)-7-hydroxytaxiresinol (CHEBI:70193) is a oxolanes (CHEBI:26912)
(7R)-7-hydroxytaxiresinol (CHEBI:70193) is a polyphenol (CHEBI:26195)
IUPAC Name 
4-[(2S,3R,4R)-4-[(R)-hydroxy(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)tetrahydrofuran-2-yl]benzene-1,2-diol
Registry NumbersSources
Reaxys:21220935Reaxys
Citations