Jump to:
loading...| Preferred Name |
isomethadone |
| Synonyms |
isadanone isoamidone isometadone |
| ID |
http://purl.obolibrary.org/obo/CHEBI_135321 |
| charge |
0 |
| database_cross_reference |
CAS:466-40-0 Drug_Central:1495 |
| formula |
C21H27NO |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
isadanone isoamidone isometadone |
| id |
CHEBI:135321 |
| in_subset | |
| inchi |
InChI=1S/C21H27NO/c1-5-20(23)21(17(2)16-22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3 |
| inchikey |
IFKPLJWIEQBPGG-UHFFFAOYSA-N |
| label |
isomethadone |
| mass |
309.446 |
| monoisotopicmass |
309.20926 |
| notation |
CHEBI:135321 |
| prefLabel |
isomethadone |
| smiles |
C(C(CN(C)C)C)(C(CC)=O)(C1=CC=CC=C1)C2=CC=CC=C2 |
| treeView | |
| subClassOf |