RefMet Compound Details
MW structure | 57455 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | 2E-Octadecenoyl-CoA | |
Alternative name | CoA 18:1(2E) | |
Systematic name | 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-octadec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} | |
SMILES | CCCCCCCCCCCCCCC/C=C/C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@H](n2cnc3c(N)ncnc23)O1)O)OP(=O)(O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Sum Composition | CoA 18:1 | View other entries in RefMet with this sum composition |
Exact mass | 1031.360534 (neutral) |
Table of KEGG reactions in human pathways involving 2E-Octadecenoyl-CoA
Rxn ID | KEGG Reaction | Enzyme |
---|---|---|
R07760 | 3-Hydroxyoctadecanoyl-CoA <=> (2E)-Octadecenoyl-CoA + H2O | 3-Hydroxyoctadecanoyl-CoA <=> (2E)-Octadecenoyl-CoA + H2O |
R07761 | (2E)-Octadecenoyl-CoA + NADPH + H+ <=> Stearoyl-CoA + NADP+ | octadecanoyl-CoA:NADP+ trans-2-oxidoreductase |
Table of KEGG human pathways containing 2E-Octadecenoyl-CoA
Pathway ID | Human Pathway | # of reactions |
---|---|---|
hsa01212 | Fatty acid metabolism | 2 |