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CHEBI:39588 - 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOL

Default Structure
ChEBI IDCHEBI:39588
ChEBI Name4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOL
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H22O2S
Net Charge0
Average Mass302.439
Monoisotopic Mass302.13405
SMILES[H]Oc1c([H])c([H])c(Sc2c([H])c([H])c(O[H])c(C([H])(C([H])([H])[H])C([H])([H])[H])c2[H])c([H])c1C([H])(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C18H22O2S/c1-11(2)15-9-13(5-7-17(15)19)21-14-6-8-18(20)16(10-14)12(3)4/h5-12,19-20H,1-4H3
InChIKeyNEMLLZAROZVCCE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOL (CHEBI:39588) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOLPDBeChem
4,4'-sulfanediylbis[2-(1-methylethyl)phenol]PDBeChem
Manual XrefsDatabases
178PDBeChem