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CHEBI:754747 - nalmexone

Default Structure
ChEBI IDCHEBI:754747
ChEBI Namenalmexone
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC21H25NO4
Net Charge0
Average Mass355.434
Monoisotopic Mass355.17836
SMILES[H][C@@]12Oc3c(O)ccc4c3[C@@]13CCN(CC=C(C)C)[C@]([H])(C4)[C@]3(O)CCC2=O
InChIInChI=1S/C21H25NO4/c1-12(2)6-9-22-10-8-20-17-13-3-4-14(23)18(17)26-19(20)15(24)5-7-21(20,25)16(22)11-13/h3-4,6,16,19,23,25H,5,7-11H2,1-2H3/t16-,19+,20+,21-/m1/s1
InChIKeyOHKCLOQPSLQCQR-MBPVOVBZSA-N
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
nalmexone (CHEBI:754747) is a phenanthrenes (CHEBI:25961)
INNs  Source
nalmexonaWHO MedNet
nalmexoneWHO MedNet
Citations