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CHEBI:174894 - Nordihydroguaiaretate

ChEBI IDCHEBI:174894
ChEBI NameNordihydroguaiaretate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O4
Net Charge0
Average Mass302.370
Monoisotopic Mass302.15181
SMILESC[C@@H](Cc1ccc(O)c(O)c1)[C@@H](C)Cc1ccc(O)c(O)c1
InChIInChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3/t11-,12-/m0/s1
InChIKeyHCZKYJDFEPMADG-RYUDHWBXSA-N
ChEBI Ontology
Outgoing Relation(s)
Nordihydroguaiaretate (CHEBI:174894) is a lignan (CHEBI:25036)
IUPAC Name 
4-[(2S,3S)-4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diol
Manual XrefsDatabases
599529ChemSpider
30ZPDBeChem
C10719KEGG COMPOUND
CPD-7661MetaCyc
HMDB0012270HMDB
Registry NumbersSources
CAS:103185-28-0ChemIDplus