Sebacyl-CoA

cas: 111261-46-2 — see every product listed under this CAS number, including other names

Sebacyl-CoA (CAS 111261-46-2) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-CE01564-Get quote
cas111261-46-2
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Structural formula: {0} (CAS {1})

Decanedioyl-CoA is an alpha, dicarboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with one of the carboxy groups of decanedioic acid. It is functionally related to a sebacic acid. It is a conjugate acid of a decanedioyl-CoA(5-).

Source: ChEBI

Identity
Molecular formulaC31H52N7O19P3S
Molecular weight951.8 g/mol
IUPAC name10-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-10-oxodecanoic acid
InChIKeyJZXNELIZHJCEFA-PVMJKYSESA-N
SMILESCC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCC(=O)O)O

Computed by PubChem (NCBI)

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