ACO
ACETYL COENZYME *A
Find entries where: ACO
is present as a standalone ligand in 290 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 4 entries
Chemical Component Summary | |
|---|---|
| Name | ACETYL COENZYME *A |
| Identifiers | S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethyl] ethanethioate |
| Formula | C23 H38 N7 O17 P3 S |
| Molecular Weight | 809.571 |
| Type | NON-POLYMER |
| Isomeric SMILES | CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)CO[P@](=O)(O)O[P@@](=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O |
| InChI | InChI=1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38)/t13-,16-,17-,18+,22-/m1/s1 |
| InChIKey | ZSLZBFCDCINBPY-ZSJPKINUSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 89 |
| Chiral Atom Count | 7 |
| Bond Count | 91 |
| Aromatic Bond Count | 10 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 444493 |
| ChEBI | CHEBI:15351 |
