Analytenname

(S)-2-Methylbutyryl-CoA Sodium Salt

Molekularformel

C26H44N7O17P3S . xNa

Molekulargewicht

873.6

SMILES

O[C@@H]([C@H](N1C2=NC=NC(N)=C2N=C1)O[C@@H]3COP(OP(OCC(C)([C@H](C(NCCC(NCCSC([C@H](CC)C)=O)=O)=O)O)C)(O)=O)(O)=O)[C@@H]3OP(O)(O[Na])=O

InChI

InChI=1S/C26H44N7O17P3S.Na/c1-5-14(2)25(38)54-9-8-28-16(34)6-7-29-23(37)20(36)26(3,4)11-47-53(44,45)50-52(42,43)46-10-15-19(49-51(39,40)41)18(35)24(48-15)33-13-32-17-21(27)30-12-31-22(17)33;/h12-15,18-20,24,35-36H,5-11H2,1-4H3,(H,28,34)(H,29,37)(H,42,43)(H,44,45)(H2,27,30,31)(H2,39,40,41);/q;+1/p-1/t14-,15+,18+,19+,20-,24+;/m0./s1

IUPAC

sodium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(((hydroxy((hydroxy((R)-3-hydroxy-2,2-dimethyl-4-((3-((2-(((S)-2-methylbutanoyl)thio)ethyl)amino)-3-oxopropyl)amino)-4-oxobutoxy)phosphoryl)oxy)phosphoryl)oxy)methyl)tetrahydrofuran-3-yl hydrogen phosphate

Abweichende CAS-Nummer

87069-91-8

Lagertemperatur

-20°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat