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17215925 ChemSpider 7722-84-1 CAS C2H4O2 Acetic acid 60.02113 C23H38N7O17P3S Acetyl-CoA 809.1258 937 ChemSpider Adenosine triphosphate Cytochrome P450 2E1 Acetaldehyde 1.0 HMDB0003125 HMDB ReactionCatalysis1449 ACTIVATION 439153 PubChem-compound 64-19-7 CAS SMILES O SMILES OO Ethanol C10H14N5O7P Adenosine monophosphate 347.06308 1.0 4.0 CHEBI:16027 ChEBI HMDB0000538 HMDB NADPH ATP BioCyc P04040 UniProt Acetaldehyde 6816 PubChem-compound 1.0 559142 ChemSpider CHEBI:15846 ChEBI CHEBI:16236 ChEBI 702 PubChem-compound 53-59-8 CAS BTO:0000759 BRENDA TISSUE ONTOLOGY Alcohol dehydrogenase 1B 5742 ChemSpider 1038 PubChem-compound 1.0 1.1.1.1 false 1.1.1.1 Ethanol + NAD → Acetaldehyde + Hydrogen Ion + NADH LEFT_TO_RIGHT CHEBI:16474 ChEBI 952 ChemSpider 1.0 Aldehyde dehydrogenase, mitochondrial CHEBI:16908 ChEBI 5858 ChemSpider 1.0 C00469 KEGG Compound Adenosine monophosphate CHEBI:16240 ChEBI 1010 ChemSpider 1.0 SMILES CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCS Acetic acid Alcohol dehydrogenase 1B PPI BioCyc C21H30N7O17P3 NADPH 745.0911 Aldehyde dehydrogenase X, mitochondrial C21H29N7O17P3 NADP 744.08325 Acetyl-CoA Alcohol dehydrogenase 1B NADPH BioCyc 1.0 Catalase Aldehyde dehydrogenase X, mitochondrial Water CPD-6641 BioCyc Catalase ETOH BioCyc 58-68-4 CAS C2H6O Ethanol 46.041866 HMDB0001423 HMDB Adenosine monophosphate HMDB0000217 HMDB 1.11.1.6 false 1.11.1.6 Ethanol + Hydrogen peroxide → Acetaldehyde + 2 Water LEFT_TO_RIGHT Acetyl-coenzyme A synthetase, cytoplasmic 6.2.1.1 false 6.2.1.1 Acetic acid + Adenosine triphosphate + Coenzyme A → Acetyl-CoA + Adenosine monophosphate + Pyrophosphate LEFT_TO_RIGHT C00007 KEGG Compound Oxygen Reaction727 false Ethanol + NADPH + Oxygen → Acetaldehyde + NADP + Water LEFT_TO_RIGHT C00006 KEGG Compound CHEBI:18009 ChEBI C00001 KEGG Compound 1.0 1.0 CHEBI:18361 ChEBI NADH C00005 KEGG Compound C00004 KEGG Compound C00003 KEGG Compound Liver C00002 KEGG Compound SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O HMDB0000221 HMDB GO:0005759 GENE ONTOLOGY SMILES NC(=O)C1=CN(C=CC1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H]2O[C@@H]([C@@H](OP(O)(O)=O)[C@H]2O)N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1O Pyrophosphate 682 ChemSpider Coenzyme A P00325 UniProt 53-57-6 CAS C21H28N7O14P2 NAD 664.11694 1.0 Hydrogen peroxide Adenosine triphosphate HMDB0000108 HMDB C00010 KEGG Compound HMDB0000902 HMDB Hydrogen Ion C00013 KEGG Compound 1.0 O7P2 Pyrophosphate 173.91193 C21H29N7O14P2 NADH 665.12476 Cytochrome P450 2E1 NAD(P) BioCyc 5957 PubChem-compound HMDB0001206 HMDB 1.0 H Hydrogen Ion 1.007825 Acetaldehyde 56-65-5 CAS 53-84-9 CAS C00020 KEGG Compound 2.0 C00027 KEGG Compound C00024 KEGG Compound 1.0 ACET BioCyc GO:0005737 GENE ONTOLOGY 1.0 Coenzyme A Acetaldehyde 1.0 Endoplasmic Reticulum Membrane Q9NR19 UniProt NADH C00033 KEGG Compound SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O Transport20 false Acetic acid (→) Transport: Homo sapiens, Liver, Cell, Cytoplasm to Homo sapiens, Cell, Cytoplasm LEFT_TO_RIGHT 1.0 5682 ChemSpider SMILES NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O CHEBI:1146900 ChEBI Peroxisome AMP BioCyc 2.0 HYDROGEN-PEROXIDE BioCyc Mitochondrial Matrix HMDB0000250 HMDB SMILES [O-]P([O-])(=O)OP([O-])([O-])=O 1.0 14000-31-8 CAS 1.0 Transport17 false Acetaldehyde (→) Transport: Homo sapiens, Liver, Cell, Endoplasmic Reticulum Lumen to Homo sapiens, Liver, Cell, Cytoplasm LEFT_TO_RIGHT CO-A BioCyc Transport18 false Ethanol (→) Transport: Homo sapiens, Liver, Cell, Cytoplasm to Homo sapiens, Liver, Cell, Endoplasmic Reticulum Lumen LEFT_TO_RIGHT P05091 UniProt 5675 ChemSpider 72-89-9 CAS P30837 UniProt 763 ChemSpider C21H36N7O16P3S Coenzyme A 767.11523 Ethanol Degradation 1.2.1.3 false 1.2.1.3 Acetaldehyde + NAD + Water → Acetic acid + Hydrogen Ion + NADH LEFT_TO_RIGHT Cytoplasm 1.0 Ethanol 1.0 Acetyl-coenzyme A synthetase, cytoplasmic 784 PubChem-compound CHEBI:15422 ChEBI 6557 ChemSpider Acetyl-coenzyme A synthetase 2-like, mitochondrial 1.0 Homo sapiens SMILES CC(O)=O SMILES CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N 388299 ChemSpider 7732-18-5 CAS 1.0 HMDB0001487 HMDB Water 61-19-8 CAS Hydrogen Ion SMILES NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1 O2 Oxygen 31.98983 4.0 1.0 GO:0005789 GENE ONTOLOGY 1.0 1.0 GO:0005788 GENE ONTOLOGY Ethanol C10H16N5O13P3 Adenosine triphosphate 506.99576 BiologicalState10 Homo sapiens, Liver NAD 7782-44-7 CAS Pyrophosphate HMDB0001377 HMDB HMDB0000045 HMDB C2H4O Acetaldehyde 44.026215 Acetaldehyde GO:0005777 GENE ONTOLOGY HMDB0000042 HMDB Acetyl-coenzyme A synthetase 2-like, mitochondrial 9606 TAXONOMY 962 PubChem-compound CHEBI:15366 ChEBI SMP0000449 SMPDB PW000021 PathWhiz Endoplasmic Reticulum Lumen 392413 ChemSpider 64-17-5 CAS 5893 PubChem-compound C00080 KEGG Compound SMILES O=O Water C00084 KEGG Compound Aldehyde dehydrogenase, mitochondrial 75-07-0 CAS 172 ChemSpider 171 ChemSpider HMDB0002111 HMDB 1.0 CHEBI:15377 ChEBI CHEBI:15379 ChEBI CHEBI:15378 ChEBI SMILES [H+] ACETALD BioCyc 1.0 SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O 5886 PubChem-compound 1.0 SMILES CC=O Aldehyde dehydrogenase, mitochondrial CHEBI:15343 ChEBI 644102 PubChem-compound 444493 PubChem-compound Aldehyde dehydrogenase X, mitochondrial 6083 PubChem-compound Q9NUB1 UniProt 1.0 P05181 UniProt Ethanol 1.0 Acetic acid 22833512 PubChem-compound ACETYL-COA BioCyc H2O Water 18.010565 H2O2 Hydrogen peroxide 34.005478 1.0 4.0 NADH BioCyc HMDB0000990 HMDB SMILES CCO NAD BioCyc NADP ReactionCatalysis243 ACTIVATION ReactionCatalysis244 ACTIVATION ReactionCatalysis241 ACTIVATION 977 PubChem-compound HMDB0059597 HMDB ReactionCatalysis242 ACTIVATION ReactionCatalysis240 ACTIVATION 177 PubChem-compound 1.0 CHEBI:15351 ChEBI 176 PubChem-compound Acetyl-CoA 85-61-0 CAS NAD ReactionCatalysis239 ACTIVATION Catalase Alcohol dehydrogenase 1B Aldehyde dehydrogenase, mitochondrial Aldehyde dehydrogenase X, mitochondrial Cytochrome P450 2E1 Aldehyde dehydrogenase, mitochondrial Catalase Aldehyde dehydrogenase, mitochondrial Acetyl-coenzyme A synthetase, cytoplasmic Acetyl-coenzyme A synthetase 2-like, mitochondrial Acetaldehyde Acetaldehyde Ethanol Ethanol Acetic acid Acetic acid Acetic acid Acetic acid Ethanol NAD Acetaldehyde NADH H + NAD H 2 O NADH H + O 2 NADPH H 2 O NADP NAD H 2 O NADH H + Ethanol H 2 O 2 Acetaldehyde H 2 O NAD H 2 O NADH H + ATP CoA AMP PP i Acetyl-CoA ATP CoA AMP PP i Zinc (II) ion Heme Heme NADP Extra-Hepatic Cell (I) (II) (III) Endoplasmic Reticulum Peroxisome Mitochondria Mitochondria
17215925 ChemSpider 7722-84-1 CAS C2H4O2 Acetic acid 60.02113 C23H38N7O17P3S Acetyl-CoA 809.1258 937 ChemSpider Adenosine triphosphate Cytochrome P450 2E1 Acetaldehyde 1.0 HMDB0003125 HMDB ReactionCatalysis1449 ACTIVATION 439153 PubChem-compound 64-19-7 CAS SMILES O SMILES OO Ethanol C10H14N5O7P Adenosine monophosphate 347.06308 1.0 4.0 CHEBI:16027 ChEBI HMDB0000538 HMDB NADPH ATP BioCyc P04040 UniProt Acetaldehyde 6816 PubChem-compound 1.0 559142 ChemSpider CHEBI:15846 ChEBI CHEBI:16236 ChEBI 702 PubChem-compound 53-59-8 CAS BTO:0000759 BRENDA TISSUE ONTOLOGY Alcohol dehydrogenase 1B 5742 ChemSpider 1038 PubChem-compound 1.0 1.1.1.1 false 1.1.1.1 Ethanol + NAD → Acetaldehyde + Hydrogen Ion + NADH LEFT_TO_RIGHT CHEBI:16474 ChEBI 952 ChemSpider 1.0 Aldehyde dehydrogenase, mitochondrial CHEBI:16908 ChEBI 5858 ChemSpider 1.0 C00469 KEGG Compound Adenosine monophosphate CHEBI:16240 ChEBI 1010 ChemSpider 1.0 SMILES CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCS Acetic acid Alcohol dehydrogenase 1B PPI BioCyc C21H30N7O17P3 NADPH 745.0911 Aldehyde dehydrogenase X, mitochondrial C21H29N7O17P3 NADP 744.08325 Acetyl-CoA Alcohol dehydrogenase 1B NADPH BioCyc 1.0 Catalase Aldehyde dehydrogenase X, mitochondrial Water CPD-6641 BioCyc Catalase ETOH BioCyc 58-68-4 CAS C2H6O Ethanol 46.041866 HMDB0001423 HMDB Adenosine monophosphate HMDB0000217 HMDB 1.11.1.6 false 1.11.1.6 Ethanol + Hydrogen peroxide → Acetaldehyde + 2 Water LEFT_TO_RIGHT Acetyl-coenzyme A synthetase, cytoplasmic 6.2.1.1 false 6.2.1.1 Acetic acid + Adenosine triphosphate + Coenzyme A → Acetyl-CoA + Adenosine monophosphate + Pyrophosphate LEFT_TO_RIGHT C00007 KEGG Compound Oxygen Reaction727 false Ethanol + NADPH + Oxygen → Acetaldehyde + NADP + Water LEFT_TO_RIGHT C00006 KEGG Compound CHEBI:18009 ChEBI C00001 KEGG Compound 1.0 1.0 CHEBI:18361 ChEBI NADH C00005 KEGG Compound C00004 KEGG Compound C00003 KEGG Compound Liver C00002 KEGG Compound SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O HMDB0000221 HMDB GO:0005759 GENE ONTOLOGY SMILES NC(=O)C1=CN(C=CC1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H]2O[C@@H]([C@@H](OP(O)(O)=O)[C@H]2O)N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1O Pyrophosphate 682 ChemSpider Coenzyme A P00325 UniProt 53-57-6 CAS C21H28N7O14P2 NAD 664.11694 1.0 Hydrogen peroxide Adenosine triphosphate HMDB0000108 HMDB C00010 KEGG Compound HMDB0000902 HMDB Hydrogen Ion C00013 KEGG Compound 1.0 O7P2 Pyrophosphate 173.91193 C21H29N7O14P2 NADH 665.12476 Cytochrome P450 2E1 NAD(P) BioCyc 5957 PubChem-compound HMDB0001206 HMDB 1.0 H Hydrogen Ion 1.007825 Acetaldehyde 56-65-5 CAS 53-84-9 CAS C00020 KEGG Compound 2.0 C00027 KEGG Compound C00024 KEGG Compound 1.0 ACET BioCyc GO:0005737 GENE ONTOLOGY 1.0 Coenzyme A Acetaldehyde 1.0 Endoplasmic Reticulum Membrane Q9NR19 UniProt NADH C00033 KEGG Compound SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O Transport20 false Acetic acid (→) Transport: Homo sapiens, Liver, Cell, Cytoplasm to Homo sapiens, Cell, Cytoplasm LEFT_TO_RIGHT 1.0 5682 ChemSpider SMILES NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O CHEBI:1146900 ChEBI Peroxisome AMP BioCyc 2.0 HYDROGEN-PEROXIDE BioCyc Mitochondrial Matrix HMDB0000250 HMDB SMILES [O-]P([O-])(=O)OP([O-])([O-])=O 1.0 14000-31-8 CAS 1.0 Transport17 false Acetaldehyde (→) Transport: Homo sapiens, Liver, Cell, Endoplasmic Reticulum Lumen to Homo sapiens, Liver, Cell, Cytoplasm LEFT_TO_RIGHT CO-A BioCyc Transport18 false Ethanol (→) Transport: Homo sapiens, Liver, Cell, Cytoplasm to Homo sapiens, Liver, Cell, Endoplasmic Reticulum Lumen LEFT_TO_RIGHT P05091 UniProt 5675 ChemSpider 72-89-9 CAS P30837 UniProt 763 ChemSpider C21H36N7O16P3S Coenzyme A 767.11523 Ethanol Degradation 1.2.1.3 false 1.2.1.3 Acetaldehyde + NAD + Water → Acetic acid + Hydrogen Ion + NADH LEFT_TO_RIGHT Cytoplasm 1.0 Ethanol 1.0 Acetyl-coenzyme A synthetase, cytoplasmic 784 PubChem-compound CHEBI:15422 ChEBI 6557 ChemSpider Acetyl-coenzyme A synthetase 2-like, mitochondrial 1.0 Homo sapiens SMILES CC(O)=O SMILES CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N 388299 ChemSpider 7732-18-5 CAS 1.0 HMDB0001487 HMDB Water 61-19-8 CAS Hydrogen Ion SMILES NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1 O2 Oxygen 31.98983 4.0 1.0 GO:0005789 GENE ONTOLOGY 1.0 1.0 GO:0005788 GENE ONTOLOGY Ethanol C10H16N5O13P3 Adenosine triphosphate 506.99576 BiologicalState10 Homo sapiens, Liver NAD 7782-44-7 CAS Pyrophosphate HMDB0001377 HMDB HMDB0000045 HMDB C2H4O Acetaldehyde 44.026215 Acetaldehyde GO:0005777 GENE ONTOLOGY HMDB0000042 HMDB Acetyl-coenzyme A synthetase 2-like, mitochondrial 9606 TAXONOMY 962 PubChem-compound CHEBI:15366 ChEBI SMP0000449 SMPDB PW000021 PathWhiz Endoplasmic Reticulum Lumen 392413 ChemSpider 64-17-5 CAS 5893 PubChem-compound C00080 KEGG Compound SMILES O=O Water C00084 KEGG Compound Aldehyde dehydrogenase, mitochondrial 75-07-0 CAS 172 ChemSpider 171 ChemSpider HMDB0002111 HMDB 1.0 CHEBI:15377 ChEBI CHEBI:15379 ChEBI CHEBI:15378 ChEBI SMILES [H+] ACETALD BioCyc 1.0 SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O 5886 PubChem-compound 1.0 SMILES CC=O Aldehyde dehydrogenase, mitochondrial CHEBI:15343 ChEBI 644102 PubChem-compound 444493 PubChem-compound Aldehyde dehydrogenase X, mitochondrial 6083 PubChem-compound Q9NUB1 UniProt 1.0 P05181 UniProt Ethanol 1.0 Acetic acid 22833512 PubChem-compound ACETYL-COA BioCyc H2O Water 18.010565 H2O2 Hydrogen peroxide 34.005478 1.0 4.0 NADH BioCyc HMDB0000990 HMDB SMILES CCO NAD BioCyc NADP ReactionCatalysis243 ACTIVATION ReactionCatalysis244 ACTIVATION ReactionCatalysis241 ACTIVATION 977 PubChem-compound HMDB0059597 HMDB ReactionCatalysis242 ACTIVATION ReactionCatalysis240 ACTIVATION 177 PubChem-compound 1.0 CHEBI:15351 ChEBI 176 PubChem-compound Acetyl-CoA 85-61-0 CAS NAD ReactionCatalysis239 ACTIVATION Catalase Endoplasmic Reticulum ADH1B ALDH2 ALDH1B1 CYP2E1 ALDH2 CAT ALDH2 ACSS2 ACSS1 Acetaldehyde Acetaldehyde Ethanol Ethanol Acetic acid Acetic acid Acetic acid Acetic acid Ethanol NAD Acetaldehyde NADH Hydrogen Ion NAD Water NADH Hydrogen Ion Oxygen NADPH Water NADP NAD Water NADH Hydrogen Ion Ethanol Hydrogen peroxide Acetaldehyde Water NAD Water NADH Hydrogen Ion Adenosine triphosphate Coenzyme A Adenosine monophosphate Pyrophosphate Acetyl-CoA Adenosine triphosphate Coenzyme A Adenosine monophosphate Pyrophosphate