loading...| Preferred Name |
acetaldehyde |
|
| Synonyms |
ACETALDEHYDE acetaldehyde Acetaldehyde ethyl aldehyde acetaldehydes acetic aldehyde Acetaldehyd Azetaldehyd Ethanal |
|
| Definitions |
The aldehyde formed from acetic acid by reduction of the carboxy group. It is the most abundant carcinogen in tobacco smoke. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_15343 |
|
| charge |
0 |
|
| database_cross_reference |
PMID:2233695 HMDB:HMDB0000990 PMID:19396661 CAS:75-07-0 PMID:16485909 PMID:15239123 Wikipedia:Acetaldehyde PMID:4239189 PMID:7163973 PMID:11290854 UM-BBD_compID:c0160 PMID:24503565 PMID:18001279 PMID:24282063 PMID:15833031 PMID:11058591 KNApSAcK:C00007392 PMID:5526694 PMID:11087437 Reaxys:505984 PDBeChem:ACE Beilstein:505984 PMID:110589 PMID:16404561 PMID:24326678 LINCS:LSM-37193 KEGG:C00084 PMID:6036728 PMID:9171333 Gmelin:779 |
|
| definition |
The aldehyde formed from acetic acid by reduction of the carboxy group. It is the most abundant carcinogen in tobacco smoke. |
|
| formula |
C2H4O |
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_50905 http://purl.obolibrary.org/obo/CHEBI_77941 http://purl.obolibrary.org/obo/CHEBI_75772 http://purl.obolibrary.org/obo/CHEBI_25435 http://purl.obolibrary.org/obo/CHEBI_77746 http://purl.obolibrary.org/obo/CHEBI_50903 http://purl.obolibrary.org/obo/CHEBI_63248 http://purl.obolibrary.org/obo/CHEBI_75771 |
|
| has_alternative_id |
CHEBI:13703 CHEBI:22158 CHEBI:40533 CHEBI:2383 |
|
| has_exact_synonym |
ACETALDEHYDE acetaldehyde Acetaldehyde |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
ethyl aldehyde acetaldehydes acetic aldehyde Acetaldehyd Azetaldehyd Ethanal |
|
| id |
CHEBI:15343 |
|
| in_subset | ||
| inchi |
InChI=1S/C2H4O/c1-2-3/h2H,1H3 |
|
| inchikey |
IKHGUXGNUITLKF-UHFFFAOYSA-N |
|
| label |
acetaldehyde |
|
| mass |
44.05256 |
|
| monoisotopicmass |
44.02621 |
|
| notation |
CHEBI:15343 |
|
| prefLabel |
acetaldehyde |
|
| smiles |
[H]C(C)=O |
|
| subClassOf |