[English] 日本語
Yorodumi- ChemComp-00L: (1S,7S)-7-amino-7-benzyl-N-[(1S)-4-carbamimidamido-1-{(1S)-1-hydr... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 00L |
---|---|
Name | Name: ( Synonyms: MOL-126 |
-BIRD information
Type | Peptide-like / Thrombin Inhibitor |
---|---|
Downloads | Molecular definition / Chemical definition / Family definition |
Synonyms |
|
Annotation |
|
External info | |
Family | alpha-ketoamide Thrombin Inhibitor MOL-106 / MOL-126 / MOL-127 |
-Chemical information
Composition | Formula: C30H42N8O4 / Number of atoms: 84 / Formula weight: 578.706 / Formal charge: 0 | ||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Others | Type: peptide-like / PDB classification: HETAIN / Three letter code: 00L / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1A5G / Subcomponent: 00U, 00W, PEA | ||||||||||||
History |
| ||||||||||||
External links | UniChem / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.7.5 | |
---|
-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.7.5 | [ | |
---|
-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-1a5g:
HUMAN THROMBIN COMPLEXED WITH NOVEL SYNTHETIC PEPTIDE MIMETIC INHIBITOR AND HIRUGEN