[English] 日本語
Yorodumi- ChemComp-2Y2: N-[(2R)-1-{[(2S,3R,5R)-1-cyclohexyl-3-hydroxy-5-{[2-(morpholin-4-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2Y2 |
---|---|
Name | Name: Synonyms: CP-108,420 |
-BIRD information
Type | Peptide-like / Enzyme Inhibitor |
---|---|
Downloads | Molecular definition / Chemical definition / Family definition |
Synonyms |
|
Annotation |
|
External info |
|
Family | ALC_hydroxyethylene containing peptide-like inhibitor CP-108,420 / CP-72,647 / CP81,198 |
-Chemical information
Composition | Formula: C33H48N6O5S / Number of atoms: 93 / Formula weight: 640.836 / Formal charge: 0 | ||||||
---|---|---|---|---|---|---|---|
Others | Type: peptide-like / PDB classification: HETAIN / Three letter code: 2Y2 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1FQ4 / Subcomponent: TRM, SMC, PCE, EMR | ||||||
History |
| ||||||
External links | UniChem / ChemSpider / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.0 | |
---|
-PDB entries
Showing all 1 items
PDB-1fq4:
CRYSTAL STRUCTURE OF A COMPLEX BETWEEN HYDROXYETHYLENE INHIBITOR CP-108,420 AND YEAST ASPARTIC PROTEINASE A