Produkty 2256736-80-6

CAS 2256736-80-6 to numer rejestracyjny substancji 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.

Wzór strukturalny: {0} (CAS {1})

S-[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]ethyl] 3-hydroxy-2,6-dimethyl-5-methylideneheptanethioate (CAS 2256736-80-6) to związek chemiczny o wzorze sumarycznym C31H52N7O18P3S i masie molowej 935.8 g/mol. Nazwa systematyczna IUPAC: S-[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]ethyl] 3-hydroxy-2,6-dimethyl-5-methylideneheptanethioate. InChIKey: LQMGDAUBYDSVAK-VEQIRKQXSA-N.

Dane identyfikacyjne
Wzór sumarycznyC31H52N7O18P3S
Masa molowa935.8 g/mol
Nazwa IUPACS-[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]ethyl] 3-hydroxy-2,6-dimethyl-5-methylideneheptanethioate
InChIKeyLQMGDAUBYDSVAK-VEQIRKQXSA-N
SMILESCC(C)C(=C)CC(C(C)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)O

Dane obliczone przez PubChem (NCBI)