S-(hydrogen2-ethylpropanedioate)coenzymeA

cas: 6049-57-6 — see every product listed under this CAS number, including other names

S-(hydrogen2-ethylpropanedioate)coenzymeA (CAS 6049-57-6) is a chemical reagent available from Chemat. Available pack sizes: 1mg. Offered by: Chemat.

brandChemat
catalog numberCh12EPVP-1mg
cas6049-57-6
size1mg
availability 0.004g
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Available pack sizes

brand size price
Chemat 1mg 3040.40 Pln

properties

delivery time3 weeks
Structural formula: {0} (CAS {1})

2-[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]ethylsulfanylcarbonyl]butanoic acid (CAS 6049-57-6) is a chemical compound with the molecular formula C26H42N7O19P3S and a molecular weight of 881.6 g/mol. IUPAC name: 2-[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]ethylsulfanylcarbonyl]butanoic acid. InChIKey: VUGZQVCBBBEZQE-MIZDRFBCSA-N.

Identity
Molecular formulaC26H42N7O19P3S
Molecular weight881.6 g/mol
IUPAC name2-[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]ethylsulfanylcarbonyl]butanoic acid
InChIKeyVUGZQVCBBBEZQE-MIZDRFBCSA-N
SMILESCCC(C(=O)O)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](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

Computed by PubChem (NCBI)

Synonyms: Ethylmalonyl coenzyme A, S-(hydrogen2-ethylpropanedioate)coenzymeA, ethylmalonyl-CoA, Ethylmalonyl Coenzyme A (sodium salt), orb3022245, PubChem CID: 16757550; (Acyl-CoA); [M+H]+;
Related forms of this compound
(2S)-2-[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]ethylsulfanylcarbonyl]butanoic acid C26H42N7O19P3S
Isomers (same molecular formula)
5-[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]-5-oxopentanoic acid C26H42N7O19P3S

Also listed as

Ethylmalonyl Coenzyme A GLPBio CAS 6049-57-6
Ethylmalonyl-CoA MedChemExpress CAS 6049-57-6