S-Acetonyl-CoA

cas: 75179-85-0 — see every product listed under this CAS number, including other names

S-Acetonyl-CoA (CAS 75179-85-0) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

brand	MedChemExpress
catalog number	HY-E70394-Get quote
cas	75179-85-0
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[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[2-(2-oxopropylsulfanyl)ethylamino]propyl]amino]butyl] hydrogen phosphate (CAS 75179-85-0) is a chemical compound with the molecular formula C24H40N7O17P3S and a molecular weight of 823.6 g/mol. IUPAC name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[2-(2-oxopropylsulfanyl)ethylamino]propyl]amino]butyl] hydrogen phosphate. InChIKey: GAMKENBUYYJLCQ-NDZSKPAWSA-N.

Identity
Molecular formula	C₂₄H₄₀N₇O₁₇P₃S
Molecular weight	823.6 g/mol
IUPAC name	[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[2-(2-oxopropylsulfanyl)ethylamino]propyl]amino]butyl] hydrogen phosphate
InChIKey	GAMKENBUYYJLCQ-NDZSKPAWSA-N
SMILES	CC(=O)CSCCNC(=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: Acetonyl-coenzyme A, S-Acetonyl-coa, S-Acetonyl coa, S-Acetonyl-coenzyme A, Coenzyme A, S-(2-oxopropyl)-, SOP, orb3145113, S-Acetonyl CoA; (Acyl-CoA); [M+H]+;