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Octanoyl-CoA (Synonyms:辛酰基辅酶A;Octanoyl Coenzyme A)
Catalog No. : FM032 Purity : BR/95%以上 Brand : CHEMSOON Cas No. : 1264-52-4 PubChem Id : 445344
capryloyl-CoA is a natural product found in Homo sapiens with data available.
Octanoyl-CoA
Cas No. : 1264-52-4
Specification No. Purity Package Inventory Price
FM032-2mg BR/95%以上 2mg
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FM032-5mg BR/95%以上 5mg
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Product Name: Octanoyl-CoA
Other Names: 辛酰基辅酶A;Octanoyl Coenzyme A
CAS:1264-52-4
Structural Information
Molecular Formula C29H50N7O17P3S Molecular Weight 893.73
IUPAC Name  S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-hydroxy-2-methylbutanethioate
InChIKey  PEKYNTFSOBAABV-UHFFFAOYSA-N
InChI  InChI=1S/C26H44N7O18P3S/c1-13(14(2)34)25(39)55-8-7-28-16(35)5-6-29-23(38)20(37)26(3,4)10-48-54(45,46)51-53(43,44)47-9-15-19(50-52(40,41)42)18(36)24(49-15)33-12-32-17-21(27)30-11-31-22(17)33/h11-15,18-20,24,34,36-37H,5-10H2,1-4H3,(H,28,35)(H,29,38)(H,43,44)(H,45,46)(H2,27,30,31)(H2,40,41,42)
SMILES  CC(C(C)O)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Literature

1.Identification of an α-Oxoamine Synthase and a One-Pot Two-Step Enzymatic Synthesis of α-Amino Ketones. Zhou, Ting et al. Organic Letters, 23(1), 37-41; 2021

2.A KAS-III Heterodimer in Lipstatin Biosynthesis Nondecarboxylatively Condenses C8 and C14 Fatty Acyl-CoA Substrates by a Variable Mechanism during the Establishment of a C22 Aliphatic Skeleton. Zhang, Daozhong et al. Journal of the American Chemical Society, 141(9), 3993-4001; 2019

3.Identification of Middle Chain Fatty Acyl-CoA Ligase Responsible for the Biosynthesis of 2-Alkylmalonyl-CoAs for Polyketide Extender Unit. Miyazawa, Takeshi et al. Journal of Biological Chemistry, 290(45), 26994-27011; 2015

4.Synthesis of coenzyme A thioesters using methyl acyl phosphates in an aqueous medium. Pal, Mohan and Bearne, Stephen L.. Organic & Biomolecular Chemistry, 12(48), 9760-9763; 2014

5.Multiplexing of Combinatorial Chemistry in Antimycin Biosynthesis: Expansion of Molecular Diversity and Utility. Yan, Yan et al. Angewandte Chemie, International Edition, 52(47), 12308-12312; 2013

6.A Three Enzyme Pathway for 2-Amino-3-hydroxycyclopent-2-enone Formation and Incorporation in Natural Product Biosynthesis. Zhang, Wenjun et al. Journal of the American Chemical Society, 132(18), 6402-6411; 2010

7.Harnessing the Chemical Activation Inherent to Carrier Protein-Bound Thioesters for the Characterization of Lipopeptide Fatty Acid Tailoring Enzymes. Kopp, Florian et al. Journal of the American Chemical Society, 130(8), 2656-2666; 2008