+Open data
-Basic information
Entry | Database: PDB chemical components / ID: CAA | ||
---|---|---|---|
Name | Name: Wikipedia | Wikipedia - Acetoacetyl-CoA: Acetoacetyl CoA is the precursor of HMG-CoA in the mevalonate pathway, which is essential for cholesterol biosynthesis. It also takes a similar role in the ketone bodies synthesis (ketogenesis) pathway of the liver... | |
-Chemical information
Composition | Formula: C25H40N7O18P3S / Number of atoms: 94 / Formula weight: 851.607 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAC / Three letter code: CAA / Model coordinates PDB-ID: 1DUB | ||||
History |
| ||||
External links | UniChem / Brenda / ChEBI / DrugBank / GtoPharmacology / HMDB / LipidMaps / Metabolights / NMRShiftDB / Nikkaji / PubChem / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
---|
-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
---|