EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:43768 - 6-[4-(methylsulfonyl)phenyl]-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-ol

ChEBI IDCHEBI:43768
ChEBI Name6-[4-(methylsulfonyl)phenyl]-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-ol
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC30H31NO5S
Net Charge0
Average Mass517.647
Monoisotopic Mass517.19229
SMILES[H]Oc1c([H])c([H])c2c(Oc3c([H])c([H])c(OC([H])([H])C([H])([H])N4C([H])([H])C([H])([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c3[H])c(-c3c([H])c([H])c(S(=O)(=O)C([H])([H])[H])c([H])c3[H])c([H])c([H])c2c1[H]
InChIInChI=1S/C30H31NO5S/c1-37(33,34)27-13-5-22(6-14-27)28-15-7-23-21-24(32)8-16-29(23)30(28)36-26-11-9-25(10-12-26)35-20-19-31-17-3-2-4-18-31/h5-16,21,32H,2-4,17-20H2,1H3
InChIKeyNJVFOFMHUJJIMB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-[4-(methylsulfonyl)phenyl]-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-ol (CHEBI:43768) is a N-oxyethylpiperidine (CHEBI:48737)
6-[4-(methylsulfonyl)phenyl]-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-ol (CHEBI:43768) is a naphthols (CHEBI:25392)
Synonyms  Source
6-(4-METHYLSULFONYL-PHENYL)-5-[4-(2-PIPERIDIN-1-YLETHOXY)PHENOXY]NAPHTHALEN-2-OLPDBeChem
6-[4-(methylsulfonyl)phenyl]-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-olPDBeChem
Manual XrefsDatabases
L4GPDBeChem