Loading Pathway...
Crotonobetainyl-CoA C00318 KEGG Compound 937 ChemSpider 3315 PubChem-compound Probable crotonobetaine/carnitine-CoA ligase CHEBI:1146900 ChEBI AMP BioCyc Water SMILES O 2.0 C10H14N5O7P Adenosine monophosphate 347.06308 SMILES [H]\C(C[N+](C)(C)C)=C(\[H])C(=O)SCCN=C(O)CCN=C(O)[C@@](O)([H])C(C)(C)COP(=O)(O)OP(O)(=O)OC[C@@]1([H])O[C@@]([H])(N2C=NC3=C(N)N=CN=C23)[C@@](O)([H])[C@]1([H])OP(=O)(O)O CHEBI:16027 ChEBI CO-A BioCyc 591 PubChem-compound ATP BioCyc http://identifiers.org/smpdb/SMP02051 SMPDB Coenzyme A Crotonobetainyl-CoA dehydrogenase 1.0 10917 PubChem-compound C21H36N7O16P3S Coenzyme A 767.11523 6816 PubChem-compound L-Carnitine HMDB00538 HMDB C7H15NO3 L-Carnitine 161.1052 10455 ChemSpider SMILES CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12)C(O)C(O)=NCCC(O)=NCCSC(=O)CCC[N+](C)(C)C P31552 UniProt L-Carnitinyl-CoA P31551 UniProt CHEBI:15422 ChEBI Crotonobetainyl-CoA:carnitine CoA-transferase Carnitinyl-CoA dehydratase reduced electron acceptor 6557 ChemSpider 5742 ChemSpider 7732-18-5 CAS γ-butyrobetainyl-CoA:carnitine CoA transferase diphosphate 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 Adenosine monophosphate 1.0 1.0 SMILES CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12)C(O)C(O)=NCCC(O)=NCCSC(=O)CC(O)C[N+](C)(C)C 5858 ChemSpider gamma-Butyrobetainyl-CoA C10H16N5O13P3 Adenosine triphosphate 506.99576 C28H48N8O17P3S Crotonobetainyl-CoA 893.2071 1.0 SMILES CC1=C(C=CC(=C1)C1=CC(C)=C(C=C1)N=NC1=C(O)C2=C(C=C1)C(=CC(=C2N)S(O)(=O)=O)S(O)(=O)=O)N=NC1=C(O)C2=C(C=C1)C(=CC(=C2N)S(O)(=O)=O)S(O)(=O)=O 705 ChemSpider C7H15NO2 3-Dehydroxycarnitine 145.11028 CHEBI:16244 ChEBI SMILES C[N+](C)(C)C[C@H](O)CC([O-])=O Probable crotonobetaine/carnitine-CoA ligase 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 1.0 1.0 962 PubChem-compound 1.0 1.0 HMDB01423 HMDB P31572 UniProt C28H50N8O17P3S gamma-Butyrobetainyl-CoA 895.2227 725 PubChem-compound 541-15-1 CAS 3-Dehydroxycarnitine HMDB06831 HMDB Adenosine triphosphate HMDB02111 HMDB 605 PubChem-compound 726 PubChem-compound CHEBI:15377 ChEBI CHEBI:16347 ChEBI C28H50N8O18P3S L-Carnitinyl-CoA 911.21765 oxidized electron acceptor PW002037 PathWhiz C00001 KEGG Compound P60584 UniProt 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 Carnitinyl-CoA dehydratase 1.0 C34H28N6O14S4 diphosphate 872.0546 HMDB00062 HMDB Crotonobetainyl-CoA:carnitine CoA-transferase C00002 KEGG Compound SMILES C[N+](C)(C)CCCC([O-])=O 1.0 C05543 KEGG Compound 1.0 6083 PubChem-compound reduced electron acceptor C00010 KEGG Compound Crotonobetainyl-CoA dehydrogenase 1.3.99.- false 1.3.99.- Crotonobetainyl-CoA + reduced electron acceptor → gamma-Butyrobetainyl-CoA + oxidized electron acceptor LEFT_TO_RIGHT 2.8.3.21 false 2.8.3.21 L-Carnitine + gamma-Butyrobetainyl-CoA → 3-Dehydroxycarnitine + L-Carnitinyl-CoA LEFT_TO_RIGHT 407-64-7 CAS H2O Water 18.010565 5957 PubChem-compound 6.2.1.- false 6.2.1.- Adenosine triphosphate + Coenzyme A + L-Carnitine → Adenosine monophosphate + L-Carnitinyl-CoA + diphosphate LEFT_TO_RIGHT 4.2.1.149 false 4.2.1.149 L-Carnitinyl-CoA → Crotonobetainyl-CoA + Water LEFT_TO_RIGHT HMDB00045 HMDB CARNITINE BioCyc L-carnitine degradation I oxidized electron acceptor 56-65-5 CAS C00020 KEGG Compound 1.0 ReactionCatalysis5913 ACTIVATION ReactionCatalysis5916 ACTIVATION ReactionCatalysis5915 ACTIVATION ReactionCatalysis5914 ACTIVATION 85-61-0 CAS Probable crotonobetaine/carnitine- CoA ligase Carnitinyl-CoA dehydratase Crotonobetainyl- CoA dehydrogenase Crotonobetainyl- CoA:carnitine CoA-transferase L-Carnitine CoA ATP L-Carnitinyl- CoA AMP diphosphate Crotonobetainyl- CoA H 2 O gamma- Butyrobetainyl- CoA L-Carnitine 3- Dehydroxycarnitine reduced electron acceptor oxidized electron acceptor
Crotonobetainyl-CoA C00318 KEGG Compound 937 ChemSpider 3315 PubChem-compound Probable crotonobetaine/carnitine-CoA ligase CHEBI:1146900 ChEBI AMP BioCyc Water SMILES O 2.0 C10H14N5O7P Adenosine monophosphate 347.06308 SMILES [H]\C(C[N+](C)(C)C)=C(\[H])C(=O)SCCN=C(O)CCN=C(O)[C@@](O)([H])C(C)(C)COP(=O)(O)OP(O)(=O)OC[C@@]1([H])O[C@@]([H])(N2C=NC3=C(N)N=CN=C23)[C@@](O)([H])[C@]1([H])OP(=O)(O)O CHEBI:16027 ChEBI CO-A BioCyc 591 PubChem-compound ATP BioCyc http://identifiers.org/smpdb/SMP02051 SMPDB Coenzyme A Crotonobetainyl-CoA dehydrogenase 1.0 10917 PubChem-compound C21H36N7O16P3S Coenzyme A 767.11523 6816 PubChem-compound L-Carnitine HMDB00538 HMDB C7H15NO3 L-Carnitine 161.1052 10455 ChemSpider SMILES CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12)C(O)C(O)=NCCC(O)=NCCSC(=O)CCC[N+](C)(C)C P31552 UniProt L-Carnitinyl-CoA P31551 UniProt CHEBI:15422 ChEBI Crotonobetainyl-CoA:carnitine CoA-transferase Carnitinyl-CoA dehydratase reduced electron acceptor 6557 ChemSpider 5742 ChemSpider 7732-18-5 CAS γ-butyrobetainyl-CoA:carnitine CoA transferase diphosphate 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 Adenosine monophosphate 1.0 1.0 SMILES CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12)C(O)C(O)=NCCC(O)=NCCSC(=O)CC(O)C[N+](C)(C)C 5858 ChemSpider gamma-Butyrobetainyl-CoA C10H16N5O13P3 Adenosine triphosphate 506.99576 C28H48N8O17P3S Crotonobetainyl-CoA 893.2071 1.0 SMILES CC1=C(C=CC(=C1)C1=CC(C)=C(C=C1)N=NC1=C(O)C2=C(C=C1)C(=CC(=C2N)S(O)(=O)=O)S(O)(=O)=O)N=NC1=C(O)C2=C(C=C1)C(=CC(=C2N)S(O)(=O)=O)S(O)(=O)=O 705 ChemSpider C7H15NO2 3-Dehydroxycarnitine 145.11028 CHEBI:16244 ChEBI SMILES C[N+](C)(C)C[C@H](O)CC([O-])=O Probable crotonobetaine/carnitine-CoA ligase 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 1.0 1.0 962 PubChem-compound 1.0 1.0 HMDB01423 HMDB P31572 UniProt C28H50N8O17P3S gamma-Butyrobetainyl-CoA 895.2227 725 PubChem-compound 541-15-1 CAS 3-Dehydroxycarnitine HMDB06831 HMDB Adenosine triphosphate HMDB02111 HMDB 605 PubChem-compound 726 PubChem-compound CHEBI:15377 ChEBI CHEBI:16347 ChEBI C28H50N8O18P3S L-Carnitinyl-CoA 911.21765 oxidized electron acceptor PW002037 PathWhiz C00001 KEGG Compound P60584 UniProt 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 Carnitinyl-CoA dehydratase 1.0 C34H28N6O14S4 diphosphate 872.0546 HMDB00062 HMDB Crotonobetainyl-CoA:carnitine CoA-transferase C00002 KEGG Compound SMILES C[N+](C)(C)CCCC([O-])=O 1.0 C05543 KEGG Compound 1.0 6083 PubChem-compound reduced electron acceptor C00010 KEGG Compound Crotonobetainyl-CoA dehydrogenase 1.3.99.- false 1.3.99.- Crotonobetainyl-CoA + reduced electron acceptor → gamma-Butyrobetainyl-CoA + oxidized electron acceptor LEFT_TO_RIGHT 2.8.3.21 false 2.8.3.21 L-Carnitine + gamma-Butyrobetainyl-CoA → 3-Dehydroxycarnitine + L-Carnitinyl-CoA LEFT_TO_RIGHT 407-64-7 CAS H2O Water 18.010565 5957 PubChem-compound 6.2.1.- false 6.2.1.- Adenosine triphosphate + Coenzyme A + L-Carnitine → Adenosine monophosphate + L-Carnitinyl-CoA + diphosphate LEFT_TO_RIGHT 4.2.1.149 false 4.2.1.149 L-Carnitinyl-CoA → Crotonobetainyl-CoA + Water LEFT_TO_RIGHT HMDB00045 HMDB CARNITINE BioCyc L-carnitine degradation I oxidized electron acceptor 56-65-5 CAS C00020 KEGG Compound 1.0 ReactionCatalysis5913 ACTIVATION ReactionCatalysis5916 ACTIVATION ReactionCatalysis5915 ACTIVATION ReactionCatalysis5914 ACTIVATION 85-61-0 CAS caiC caiD caiA caiB L-Carnitine Coenzyme A Adenosine triphosphate L-Carnitinyl- CoA Adenosine monophosphate diphosphate Crotonobetainyl- CoA Water gamma- Butyrobetainyl- CoA L-Carnitine 3- Dehydroxycarnitine reduced electron acceptor oxidized electron acceptor