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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | acetaldehyde | |
| Synonyms |
Azetaldehyd acetaldehydes Ethanal Acetaldehyd ethyl aldehyde acetic aldehyde ACETALDEHYDE acetaldehyde Acetaldehyde |
|
| 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:11058591 Wikipedia:Acetaldehyde PMID:16404561 PMID:6036728 PMID:11290854 KNApSAcK:C00007392 Reaxys:505984 PMID:16485909 HMDB:HMDB0000990 PMID:24326678 PMID:9171333 KEGG:C00084 LINCS:LSM-37193 PMID:15833031 PMID:2233695 PMID:18001279 PMID:24503565 PMID:4239189 CAS:75-07-0 PMID:15239123 PMID:19396661 PMID:5526694 PMID:11087437 PMID:110589 PDBeChem:ACE PMID:24282063 Gmelin:779 PMID:7163973 UM-BBD_compID:c0160
|
|
| 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:2383 CHEBI:40533 CHEBI:22158
|
|
| has_exact_synonym |
ACETALDEHYDE acetaldehyde Acetaldehyde
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
Azetaldehyd acetaldehydes Ethanal Acetaldehyd ethyl aldehyde acetic aldehyde
|
|
| 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
|
|
| treeView | ||
| subClassOf |
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