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17220838 ChemSpider C23H38N7O17P3S Acetyl-CoA 809.1258 937 ChemSpider C10H20O2 Capric acid 172.14633 ReactionCatalysis3745 ACTIVATION ReactionCatalysis3746 ACTIVATION NADH ReactionCatalysis3749 ACTIVATION 439153 PubChem-compound ReactionCatalysis3747 ACTIVATION SMILES O ReactionCatalysis3748 ACTIVATION fatty acid oxidation (Decanoate) C10H14N5O7P Adenosine monophosphate 347.06308 1.0 C33H58N7O17P3S Lauroyl-CoA 949.2823 CHEBI:16027 ChEBI NAD PW001020 PathWhiz ATP BioCyc 3-ketoacyl-CoA thiolase 1.0 3-OXODODECANOATE BioCyc Short-chain-fatty-acid--CoA ligase 6816 PubChem-compound 1.0 CHEBI:15846 ChEBI PW001018 PathWhiz HMDB01206 HMDB Lauroyl-CoA 440606 PubChem-compound 1.0 5742 ChemSpider 1038 PubChem-compound Capric acid HMDB59597 HMDB Adenosine monophosphate HMDB00902 HMDB CHEBI:16908 ChEBI 5858 ChemSpider Acetyl-CoA 1010 ChemSpider 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(O)C(=O)NCCC(=O)NCCS SMILES CCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(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 1.0 HMDB01423 HMDB CHEBI:15521 ChEBI Hydrogen Ion P76082 UniProt CHEBI:5086 ChEBI Adenosine triphosphate 58-68-4 CAS LAUROYLCOA-CPD BioCyc C31H52N7O17P3S (2E)-Decenoyl-CoA 919.23535 Reduced electron-transfer flavoprotein C00001 KEGG Compound 440615 PubChem-compound C01571 KEGG Compound C00004 KEGG Compound C00003 KEGG Compound C00002 KEGG Compound 1.0 C05264 KEGG Compound C05265 KEGG Compound Fatty acid oxidation complex subunit alpha an oxidized electron-transfer flavoprotein  fatty acid oxidation (laurate) SubPathway C21H28N7O14P2 NAD 664.11694 389504 ChemSpider P21151 UniProt C00010 KEGG Compound 3-ketoacyl-CoA thiolase_ 3-ketoacyl-CoA thiolase Short-chain-fatty-acid--CoA ligase C05275 KEGG Compound (2E)-Decenoyl-CoA C05274 KEGG Compound CHEBI:10723 ChEBI C21H29N7O14P2 NADH 665.12476 5957 PubChem-compound 2,3-dehydroadipyl-CoA hydratase HMDB03938 HMDB HMDB03939 HMDB P76503 UniProt 334-48-5 CAS P77399 UniProt H Hydrogen Ion 1.007825 56-65-5 CAS C00020 KEGG Compound 53-84-9 CAS 389510 ChemSpider SubPathwayInteraction2088 SubPathwayReaction SubPathway2088Reaction C00024 KEGG Compound (S)-Hydroxydecanoyl-CoA 3-Oxodecanoyl-CoA ReactionCatalysis3733 ACTIVATION 1264-57-9 CAS C31H54N7O18P3S (S)-Hydroxydecanoyl-CoA 937.2459 C31H52N7O18P3S 3-Oxodecanoyl-CoA 935.2302 P38135 UniProt CHEBI:28493 ChEBI HMDB03948 HMDB 1.0 10018-95-8 CAS 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 1.0 5682 ChemSpider Reduced electron-transfer flavoprotein 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 Fatty acid oxidation complex subunit alpha_ AMP BioCyc Water CHEBI:28528 ChEBI 50411-91-1 CAS 5280768 PubChem-compound FadJ component of anaerobic fatty acid oxidation complex HMDB06404 HMDB CO-A BioCyc 16061159 PubChem-compound Decanoyl-CoA (n-C10:0CoA) 72-89-9 CAS Coenzyme A SMILES CCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(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=C(N)N=CN=C12 C21H36N7O16P3S Coenzyme A 767.11523 C31H54N7O17P3S Decanoyl-CoA (n-C10:0CoA) 921.251 SMILES CCCCCCC[C@H](O)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(O)[C@H]1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12 HMDB00538 HMDB CHEBI:15422 ChEBI HMDB00511 HMDB 6557 ChemSpider 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 Fatty acid oxidation complex subunit alpha 7732-18-5 CAS 388299 ChemSpider 61-19-8 CAS SMILES NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1 CHEBI:30813 ChEBI 1.0 SMILES CCCCCCCCCC(O)=O SMILES CCCCCCCCCCCC(=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=C(N)N=CN=C12 C01832 KEGG Compound C10H16N5O13P3 Adenosine triphosphate 506.99576 1.0 2863 ChemSpider 3-ketoacyl-CoA thiolase_ 2,3-dehydroadipyl-CoA hydratase 1.0 165436 PubChem-compound 1.0 T2-DECENOYL-COA BioCyc 962 PubChem-compound 392413 ChemSpider 2.0 145018 ChemSpider 5893 PubChem-compound HMDB02111 HMDB 1.0 1.0 C00080 KEGG Compound CHEBI:28325 ChEBI Reaction3759 false Adenosine triphosphate + Capric acid + Coenzyme A → Adenosine monophosphate + Decanoyl-CoA (n-C10:0CoA) LEFT_TO_RIGHT SMP01036 SMPDB SMP01034 SMPDB CHEBI:15377 ChEBI CHEBI:15378 ChEBI SMILES [H+] 6245-70-1 CAS 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 HMDB03571 HMDB Fatty acid oxidation complex subunit alpha_ 1.0 1.0 HMDB01487 HMDB 4444334 ChemSpider 444493 PubChem-compound 6083 PubChem-compound acetyl-CoA C-acyltransferase 6244-92-4 CAS Reaction3773 false (2E)-Decenoyl-CoA → (S)-Hydroxydecanoyl-CoA + Water LEFT_TO_RIGHT 2969 PubChem-compound Reaction3772 false (S)-Hydroxydecanoyl-CoA → (2E)-Decenoyl-CoA LEFT_TO_RIGHT Reaction3771 true Decanoyl-CoA (n-C10:0CoA) + Hydrogen Ion + an oxidized electron-transfer flavoprotein  → (2E)-Decenoyl-CoA + Reduced electron-transfer flavoprotein LEFT_TO_RIGHT B7L9A7 UniProt an oxidized electron-transfer flavoprotein  ACETYL-COA BioCyc H2O Water 18.010565 SMILES CCCCCCC\C=C\C(=O)SCCNC(=O)CCNC(=O)C(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=C(N)N=CN=C12 NADH BioCyc Reaction3775 false 3-Oxodecanoyl-CoA + Coenzyme A → Acetyl-CoA + Lauroyl-CoA LEFT_TO_RIGHT Reaction3774 false (S)-Hydroxydecanoyl-CoA + NAD → 3-Oxodecanoyl-CoA + Hydrogen Ion + NADH LEFT_TO_RIGHT NAD BioCyc HMDB00045 HMDB CHEBI:15351 ChEBI 85-61-0 CAS Short-chain- fatty-acid-- CoA ligase Fatty acid oxidation complex subunit alpha_ Fatty acid oxidation complex subunit alpha 2,3- dehydroadipyl- CoA hydratase 2,3- dehydroadipyl- CoA hydratase 3-ketoacyl-CoA thiolase_ 3-ketoacyl-CoA thiolase ATP CoA Capric acid AMP Decanoyl-CoA (n-C10:0CoA) H + (2E)- Decenoyl-CoA (S)- Hydroxydecanoyl- CoA H 2 O (S)- Hydroxydecanoyl- CoA NAD NADH H + 3- Oxodecanoyl- CoA CoA Acetyl-CoA Lauroyl-CoA an oxidized electron- transfer flavoprotein Reduced electron- transfer flavoprotein fatty acid oxidation (laurate)
17220838 ChemSpider C23H38N7O17P3S Acetyl-CoA 809.1258 937 ChemSpider C10H20O2 Capric acid 172.14633 ReactionCatalysis3745 ACTIVATION ReactionCatalysis3746 ACTIVATION NADH ReactionCatalysis3749 ACTIVATION 439153 PubChem-compound ReactionCatalysis3747 ACTIVATION SMILES O ReactionCatalysis3748 ACTIVATION fatty acid oxidation (Decanoate) C10H14N5O7P Adenosine monophosphate 347.06308 1.0 C33H58N7O17P3S Lauroyl-CoA 949.2823 CHEBI:16027 ChEBI NAD PW001020 PathWhiz ATP BioCyc 3-ketoacyl-CoA thiolase 1.0 3-OXODODECANOATE BioCyc Short-chain-fatty-acid--CoA ligase 6816 PubChem-compound 1.0 CHEBI:15846 ChEBI PW001018 PathWhiz HMDB01206 HMDB Lauroyl-CoA 440606 PubChem-compound 1.0 5742 ChemSpider 1038 PubChem-compound Capric acid HMDB59597 HMDB Adenosine monophosphate HMDB00902 HMDB CHEBI:16908 ChEBI 5858 ChemSpider Acetyl-CoA 1010 ChemSpider 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(O)C(=O)NCCC(=O)NCCS SMILES CCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(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 1.0 HMDB01423 HMDB CHEBI:15521 ChEBI Hydrogen Ion P76082 UniProt CHEBI:5086 ChEBI Adenosine triphosphate 58-68-4 CAS LAUROYLCOA-CPD BioCyc C31H52N7O17P3S (2E)-Decenoyl-CoA 919.23535 Reduced electron-transfer flavoprotein C00001 KEGG Compound 440615 PubChem-compound C01571 KEGG Compound C00004 KEGG Compound C00003 KEGG Compound C00002 KEGG Compound 1.0 C05264 KEGG Compound C05265 KEGG Compound Fatty acid oxidation complex subunit alpha an oxidized electron-transfer flavoprotein  C21H28N7O14P2 NAD 664.11694 389504 ChemSpider P21151 UniProt C00010 KEGG Compound 3-ketoacyl-CoA thiolase_ 3-ketoacyl-CoA thiolase Short-chain-fatty-acid--CoA ligase C05275 KEGG Compound (2E)-Decenoyl-CoA C05274 KEGG Compound CHEBI:10723 ChEBI C21H29N7O14P2 NADH 665.12476 5957 PubChem-compound 2,3-dehydroadipyl-CoA hydratase HMDB03938 HMDB HMDB03939 HMDB P76503 UniProt 334-48-5 CAS P77399 UniProt H Hydrogen Ion 1.007825 56-65-5 CAS C00020 KEGG Compound 53-84-9 CAS 389510 ChemSpider SubPathwayInteraction2088 SubPathwayReaction SubPathway2088Reaction C00024 KEGG Compound (S)-Hydroxydecanoyl-CoA 3-Oxodecanoyl-CoA ReactionCatalysis3733 ACTIVATION 1264-57-9 CAS C31H54N7O18P3S (S)-Hydroxydecanoyl-CoA 937.2459 C31H52N7O18P3S 3-Oxodecanoyl-CoA 935.2302 P38135 UniProt CHEBI:28493 ChEBI HMDB03948 HMDB 1.0 10018-95-8 CAS 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 1.0 5682 ChemSpider Reduced electron-transfer flavoprotein 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 Fatty acid oxidation complex subunit alpha_ AMP BioCyc Water CHEBI:28528 ChEBI 50411-91-1 CAS 5280768 PubChem-compound FadJ component of anaerobic fatty acid oxidation complex HMDB06404 HMDB CO-A BioCyc 16061159 PubChem-compound Decanoyl-CoA (n-C10:0CoA) 72-89-9 CAS Coenzyme A SMILES CCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(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=C(N)N=CN=C12 C21H36N7O16P3S Coenzyme A 767.11523 C31H54N7O17P3S Decanoyl-CoA (n-C10:0CoA) 921.251 SMILES CCCCCCC[C@H](O)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(O)[C@H]1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12 HMDB00538 HMDB CHEBI:15422 ChEBI HMDB00511 HMDB 6557 ChemSpider 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 Fatty acid oxidation complex subunit alpha 7732-18-5 CAS 388299 ChemSpider 61-19-8 CAS SMILES NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1 CHEBI:30813 ChEBI 1.0 SMILES CCCCCCCCCC(O)=O SMILES CCCCCCCCCCCC(=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=C(N)N=CN=C12 C01832 KEGG Compound C10H16N5O13P3 Adenosine triphosphate 506.99576 1.0 2863 ChemSpider 3-ketoacyl-CoA thiolase_ 2,3-dehydroadipyl-CoA hydratase 1.0 165436 PubChem-compound 1.0 T2-DECENOYL-COA BioCyc 962 PubChem-compound 392413 ChemSpider 2.0 145018 ChemSpider 5893 PubChem-compound HMDB02111 HMDB 1.0 1.0 C00080 KEGG Compound CHEBI:28325 ChEBI Reaction3759 false Adenosine triphosphate + Capric acid + Coenzyme A → Adenosine monophosphate + Decanoyl-CoA (n-C10:0CoA) LEFT_TO_RIGHT http://identifiers.org/smpdb/SMP01036 SMPDB http://identifiers.org/smpdb/SMP01034 SMPDB CHEBI:15377 ChEBI fatty acid oxidation (laurate) SubPathway CHEBI:15378 ChEBI SMILES [H+] 6245-70-1 CAS 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 HMDB03571 HMDB Fatty acid oxidation complex subunit alpha_ 1.0 1.0 HMDB01487 HMDB 4444334 ChemSpider 444493 PubChem-compound 6083 PubChem-compound acetyl-CoA C-acyltransferase 6244-92-4 CAS Reaction3773 false (2E)-Decenoyl-CoA → (S)-Hydroxydecanoyl-CoA + Water LEFT_TO_RIGHT 2969 PubChem-compound Reaction3772 false (S)-Hydroxydecanoyl-CoA → (2E)-Decenoyl-CoA LEFT_TO_RIGHT Reaction3771 true Decanoyl-CoA (n-C10:0CoA) + Hydrogen Ion + an oxidized electron-transfer flavoprotein  → (2E)-Decenoyl-CoA + Reduced electron-transfer flavoprotein LEFT_TO_RIGHT B7L9A7 UniProt an oxidized electron-transfer flavoprotein  ACETYL-COA BioCyc H2O Water 18.010565 SMILES CCCCCCC\C=C\C(=O)SCCNC(=O)CCNC(=O)C(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=C(N)N=CN=C12 NADH BioCyc Reaction3775 false 3-Oxodecanoyl-CoA + Coenzyme A → Acetyl-CoA + Lauroyl-CoA LEFT_TO_RIGHT Reaction3774 false (S)-Hydroxydecanoyl-CoA + NAD → 3-Oxodecanoyl-CoA + Hydrogen Ion + NADH LEFT_TO_RIGHT NAD BioCyc HMDB00045 HMDB CHEBI:15351 ChEBI 85-61-0 CAS fadK fadJ fadB paaF paaF fadI fadA Adenosine triphosphate Coenzyme A Capric acid Adenosine monophosphate Decanoyl-CoA (n-C10:0CoA) Hydrogen Ion (2E)- Decenoyl-CoA (S)- Hydroxydecanoyl- CoA Water (S)- Hydroxydecanoyl- CoA NAD NADH Hydrogen Ion 3- Oxodecanoyl- CoA Coenzyme A Acetyl-CoA Lauroyl-CoA an oxidized electron- transfer flavoprotein Reduced electron- transfer flavoprotein fatty acid oxidation (laurate)