Products 79955-48-9
CAS 79955-48-9 is the registry number for Carboxymethyl-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
Carboxymethyl-CoA is an S-alkyl-CoA having carboxymethyl as the S-alkyl component. It has a role as a Brassica napus metabolite and an EC 2.3.3.1 [citrate (Si)-synthase] inhibitor.
Source: ChEBI
| Molecular formula | C23H38N7O18P3S |
|---|---|
| Molecular weight | 825.6 g/mol |
| IUPAC name | 2-[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]ethylsulfanyl]acetic acid |
| InChIKey | OBUOSIHPWVNVJN-GRFIIANRSA-N |
| SMILES | CC(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)[C@H](C(=O)NCCC(=O)NCCSCC(=O)O)O |
Computed by PubChem (NCBI)