12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA (BioDeep_00000226577)
human metabolite
代谢物信息卡片
化学式: C44H74N7O18P3S (1113.4023694000002)
中文名称:
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CCCCCC1=C(C)C(C)=C(CCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC2OC(C(O)C2OP(O)(O)=O)N2C=NC3=C2N=CN=C3N)O1
InChI: InChI=1S/C44H74N7O18P3S/c1-6-7-15-18-31-29(2)30(3)32(66-31)19-16-13-11-9-8-10-12-14-17-20-35(53)73-24-23-46-34(52)21-22-47-42(56)39(55)44(4,5)26-65-72(62,63)69-71(60,61)64-25-33-38(68-70(57,58)59)37(54)43(67-33)51-28-50-36-40(45)48-27-49-41(36)51/h27-28,33,37-39,43,54-55H,6-26H2,1-5H3,(H,46,52)(H,47,56)(H,60,61)(H,62,63)(H2,45,48,49)(H2,57,58,59)
描述信息
12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-coa is an acyl-CoA or acyl-coenzyme A. More specifically, it is a 12-(3_4-dimethyl-5-pentylfuran-2-yl)dodecanoic acid thioester of coenzyme A. 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-coa is an acyl-CoA with 21 fatty acid group as the acyl moiety attached to coenzyme A. Coenzyme A was discovered in 1946 by Fritz Lipmann (Journal of Biological Chemistry (1946) 162 (3): 743–744) and its structure was determined in the early 1950s at the Lister Institute in London. Coenzyme A is a complex, thiol-containing molecule that is naturally synthesized from pantothenate (vitamin B5), which is found in various foods such as meat, vegetables, cereal grains, legumes, eggs, and milk. More specifically, coenzyme A (CoASH or CoA) consists of a beta-mercaptoethylamine group linked to the vitamin pantothenic acid (B5) through an amide linkage and 3-phosphorylated ADP. Coenzyme A is synthesized in a five-step process that requires four molecules of ATP, pantothenate and cysteine. It is believed that there are more than 1100 types of acyl-CoA’s in the human body, which also corresponds to the number of acylcarnitines in the human body. Acyl-CoAs exists in all living species, ranging from bacteria to plants to humans. The general role of acyl-CoA’s is to assist in transferring fatty acids from the cytoplasm to mitochondria. This process facilitates the production of fatty acids in cells, which are essential in cell membrane structure. Acyl-CoAs are also susceptible to beta oxidation, forming, ultimately, acetyl-CoA. Acetyl-CoA can enter the citric acid cycle, eventually forming several equivalents of ATP. In this way, fats are converted to ATP -- or biochemical energy. Acyl-CoAs can be classified into 9 different categories depending on the size of their acyl-group: 1) short-chain acyl-CoAs; 2) medium-chain acyl-CoAs; 3) long-chain acyl-CoAs; and 4) very long-chain acyl-CoAs; 5) hydroxy acyl-CoAs; 6) branched chain acyl-CoAs; 7) unsaturated acyl-CoAs; 8) dicarboxylic acyl-CoAs and 9) miscellaneous acyl-CoAs. Short-chain acyl-CoAs have acyl-groups with two to four carbons (C2-C4), medium-chain acyl-CoAs have acyl-groups with five to eleven carbons (C5-C11), long-chain acyl-CoAs have acyl-groups with twelve to twenty carbons (C12-C20) while very long-chain acyl-CoAs have acyl groups with more than 20 carbons. 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-coa is therefore classified as a very long chain acyl-CoA. The oxidative degradation of fatty acids is a two-step process, catalyzed by acyl-CoA synthetase/synthase. Fatty acids are first converted to their acyl phosphate, the precursor to acyl-CoA. The latter conversion is mediated by acyl-CoA synthase. Three types of acyl-CoA synthases are employed, depending on the chain length of the fatty acid. 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-coa, being a very long chain acyl-CoA is a substrate for very long chain acyl-CoA synthase. The second step of fatty acid degradation is beta oxidation. Beta oxidation occurs in mitochondria and, in the case of very long chain acyl-CoAs, the peroxisome. After its formation in the cytosol, 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA is transported into the mitochondria, the locus of beta oxidation. Transport of 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA into the mitochondria requires carnitine palmitoyltransferase 1 (CPT1), which converts 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA into 12-(3_4-dimethyl-5-pentylfuran-2-yl)dodecanoylcarnitine, which gets transported into the mitochondrial matrix. Once in the matrix, 12-(3_4-dimethyl-5-pentylfuran-2-yl)dodecanoylcarnitine is converted back to 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA by CPT2, whereupon beta-oxidation can begin. Beta oxidation of 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA occurs in four steps. First, since 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA is a very long chain acyl-CoA it is the substrate...
同义名列表
6 个代谢物同义名
4-({[({[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-N-{2-[(2-{[12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl]sulphanyl}ethyl)-C-hydroxycarbonimidoyl]ethyl}-2-hydroxy-3,3-dimethylbutanimidic acid; 4-({[({[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-N-{2-[(2-{[12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl]sulphanyl}ethyl)-C-hydroxycarbonimidoyl]ethyl}-2-hydroxy-3,3-dimethylbutanimidate; 4-({[({[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-N-{2-[(2-{[12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl]sulfanyl}ethyl)-C-hydroxycarbonimidoyl]ethyl}-2-hydroxy-3,3-dimethylbutanimidate; {[5-(6-amino-9H-purin-9-yl)-2-({[({[3-({2-[(2-{[12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid; [5-(6-aminopurin-9-yl)-2-[({[3-({2-[(2-{[12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-3-hydroxy-2,2-dimethylpropoxy(hydroxy)phosphoryl]oxy(hydroxy)phosphoryl}oxy)methyl]-4-hydroxyoxolan-3-yl]oxyphosphonic acid; 12-(3,4-dimethyl-5-pentylfuran-2-yl)dodecanoyl-CoA
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