| CAS Number | 5960-12-3 |
| Catalog Number | AG00ERM9(AGN-PC-0SSS8Y) |
| Chemical Name | cyclohexanecarboxyl-coenzyme A |
| IUPAC Name | 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] cyclohexanecarbothioate |
| InChI | InChI=1S/C28H46N7O17P3S/c1-28(2,22(38)25(39)31-9-8-18(36)30-10-11-56-27(40)16-6-4-3-5-7-16)13-49-55(46,47)52-54(44,45)48-12-17-21(51-53(41,42)43)20(37)26(50-17)35-15-34-19-23(29)32-14-33-24(19)35/h14-17,20-22,26,37-38H,3-13H2,1-2H3,(H,30,36)(H,31,39)(H,44,45)(H,46,47)(H2,29,32,33)(H2,41,42,43)/t17-,20-,21-,22+,26-/m1/s1 |
| InChI Key | QRSKGVRHSLILFG-TYHXJLICSA-N |
| MDL Number | MFCD07110211 |
| Molecular Formula | C28H46N7O17P3S |
| Molecular Weight | 877.6878 |
| SMILES | O[C@H]1[C@H](N2C=NC3=C2N=CN=C3N)O[C@H](COP(OP(OCC(C)(C)[C@@H](O)C(NCCC(NCCSC(C4CCCCC4)=O)=O)=O)(O)=O)(O)=O)[C@H]1OP(O)(O)=O |
| Synonyms | coenzyme A, cyclohexanecarboxyl-,
cyclohexanecarboxyl-CoA,
cyclohexanecarboxyl-coenzyme A,
Cyclohexanecarboxyl-coenzyme A,
Cyclohexanecarboxyl-coa,
cyclohexane-1-carbonyl-CoA,
Coenzyme A, S-cyclohexanecarboxylate,
Cyclohexane-1-carboxyl-CoA,
cyclohexane-1-carbonyl-coenzyme A,
cyclohexane-1-carboxyl-coenzyme A,
3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(cyclohexane-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate},
5960-12-3,
SCHEMBL123621,
Coenzyme A, cyclohexanecarboxyl-,
CHEBI:28557,
LMFA07050312,
C09823,
CoA(7:0),
CID11966208,
|