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CHEBI:106738 - (S)-famoxadone

ChEBI IDCHEBI:106738
ChEBI Name(S)-famoxadone
Stars
ASCII Name(S)-famoxadone
DefinitionA 5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dione that is the (active) (S)-enantiomer of famoxadone. It prevents spore germination and mycelial growth of sensitive fungi and is used in agriculture for the control of various fungal diseases.
Secondary ChEBI IDCHEBI:42515
Last Modified26 June 2018
DownloadsMolfile
FormulaC22H18N2O4
Net Charge0
Average Mass374.396
Monoisotopic Mass374.12666
SMILESC[C@@]1(c2ccc(Oc3ccccc3)cc2)OC(=O)N(Nc2ccccc2)C1=O
InChIInChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3/t22-/m0/s1
InChIKeyPCCSBWNGDMYFCW-QFIPXVFZSA-N
Roles Classification
Biological Roles:
fungicide  A substance used to destroy fungal pests.
quinone outside inhibitor  A mitochondrial cytochrome-bc1 complex inhibitor that acts at the Quinone 'outer' (Qo) binding site of the cytochrome-bc1 complex.
Applications:
fungicide  A substance used to destroy fungal pests.
quinone outside inhibitor  A mitochondrial cytochrome-bc1 complex inhibitor that acts at the Quinone 'outer' (Qo) binding site of the cytochrome-bc1 complex.
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
ChEBI Ontology
Outgoing Relation(s)
(S)-famoxadone (CHEBI:106738) has role agrochemical (CHEBI:33286)
(S)-famoxadone (CHEBI:106738) has role fungicide (CHEBI:24127)
(S)-famoxadone (CHEBI:106738) has role mitochondrial cytochrome-bc1 complex inhibitor (CHEBI:38499)
(S)-famoxadone (CHEBI:106738) has role quinone outside inhibitor (CHEBI:141153)
(S)-famoxadone (CHEBI:106738) is a 5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dione (CHEBI:83250)
(S)-famoxadone (CHEBI:106738) is enantiomer of (R)-famoxadone (CHEBI:83252)
Incoming Relation(s)
famoxadone (CHEBI:59340) has part (S)-famoxadone (CHEBI:106738)
(R)-famoxadone (CHEBI:83252) is enantiomer of (S)-famoxadone (CHEBI:106738)
IUPAC Name 
(5S)-3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione
Synonyms  Source
(S)-5-Methyl-5-(4-phenoxy-phenyl)-3-phenylamino-oxazolidine-2,4-dioneChEMBL
(S)-(−)-famoxadoneChEBI
(−)-famoxadoneChEBI
(5S)-5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dioneIUPAC
Manual XrefsDatabases
FMXPDBeChem
DB07778DrugBank
Registry NumbersSources
Reaxys:8433247Reaxys
CAS:132584-12-4ChEBI
Citations