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CHEBI:131502 - 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid

ChEBI IDCHEBI:131502
ChEBI Name7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid
Stars
DefinitionA imidazolidine-2,4-dione that is 7-(2,5-dioxoimidazolidin-4-yl)heptanoic acid in which the imidazoline ring as substituted at position 3 by a 3-(3-cyclohexyl-3-hydroxypropyl) group.
Last Modified8 March 2016
SubmitterSteve
DownloadsMolfile
FormulaC19H32N2O5
Net Charge0
Average Mass368.474
Monoisotopic Mass368.23112
SMILESO=C(O)CCCCCCC1C(=O)NC(=O)N1CCC(O)C1CCCCC1
InChIInChI=1S/C19H32N2O5/c22-16(14-8-4-3-5-9-14)12-13-21-15(18(25)20-19(21)26)10-6-1-2-7-11-17(23)24/h14-16,22H,1-13H2,(H,23,24)(H,20,25,26)
InChIKeyZIDQIOZJEJFMOH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid (CHEBI:131502) is a imidazolidine-2,4-dione (CHEBI:24628)
7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid (CHEBI:131502) is a monocarboxylic acid (CHEBI:25384)
7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid (CHEBI:131502) is a secondary alcohol (CHEBI:35681)
Incoming Relation(s)
(3R,4S)-BW 245C (CHEBI:131500) is a 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid (CHEBI:131502)
(3S,4R)-BW 245C (CHEBI:131501) is a 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid (CHEBI:131502)
IUPAC Name 
7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid
Synonym  Source
3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acidChemIDplus
Registry NumbersSources
Reaxys:964618Reaxys
CAS:75693-75-3ChemIDplus