135027-64-4 (Ibuprofenyl-CoA,Coenzyme A, S-[(αS)-α-methyl-4-(2-methylpropyl)benzeneacetate])

Coenzyme A, S-[(aS)-a-methyl-4-(2-methylpropyl)benzeneacetate];ibuprofenyl-coenzyme A;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]ethy;2-(4-Isobutylphenyl)propionyl-coa;Coenzyme A, ibuprofenyl-;Coenzyme A, S-(alpha-methyl-4-(2-methylpropyl)benzenacetate), (S)-;Ibuprofenyl-coa;S-{(9R)-17-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-9,13,15-trihydroxy-10,10-dimethyl-13,15-dioxido-4,8-dioxo-12,14,16-trioxa-3,7-diaza-13,15-diphosphaheptadec-1-yl} (2S)-2-(4-tert-butylphenyl)propanethioate (non-preferred; Coenzyme A S-[(αS)-α-methyl-4-(2- methylpropyl)benzeneacetate] ;Coenzyme A, S-[α-methyl-4-(2-methylpropyl)benzeneacetate], (S)-;Coenzyme A, S-[(αS)-α-methyl-4-(2-methylpropyl)benzeneacetate];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] (2S)-2-(4-tert-butylphenyl)propanethioate;C34H52N7O17P3S;DTXSID701347967;Ibuprofenyl-CoA; (Acyl-CoA); [M+H]+;;C34-H52-N7-O17-P3-S;135027-64-4;Coenzyme A S-[(αS)-α-methyl-4-(2-methylpropyl)benzeneacetate];

AUWPNTKLVZJJLA-FTEDYNDWSA-N

1S/C34H52N7O17P3S/c1-19(20-7-9-21(10-8-20)33(2,3)4)32(46)62-14-13-36-23(42)11-12-37-30(45)27(44)34(5,6)16-55-61(52,53)58-60(50,51)54-15-22-26(57-59(47,48)49)25(43)31(56-22)41-18-40-24-28(35)38-17-39-29(24)41/h7-10,17-19,22,25-27,31,43-44H,11-16H2,1-6H3,(H,36,42)(H,37,45)(H,50,51)(H,52,53)(H2,35,38,39)(H2,47,48,49)/t19-,22+,25+,26+,27-,31+/m0/s1

S(CCNC(CCNC([C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(N)=NC=NC2=3)O1)O)OP(=O)(O)O)O)=O)=O)C([C@@H](C)C1C=CC(=CC=1)C(C)(C)C)=O