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Yorodumi- ChemComp-ODB: (10S,14S,17R)-14-(3-carbamimidamidopropyl)-3-[[2-(hydroxymethyl)p... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: ODB |
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Name | Name: ( Synonyms: P2 macrocycle; (10S,14S,17R)-14-(3-guanidinopropyl)-3-[[2-(hydroxymethyl)phenyl]methyl]-5,12,15-trioxo-19-thia-3,6,13,16-tetrazatricyclo[19.4.0.06,10]pentacosa-1(25),21,23-triene-17-carboxamide |
-Chemical information
Composition | Formula: C33H46N8O5S / Number of atoms: 93 / Formula weight: 666.834 / Formal charge: 0 | ||||||
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Others | Type: peptide-like / PDB classification: HETAIN / Three letter code: ODB / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6GWE | ||||||
History |
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External links | UniChem / ChemSpider / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | [ | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-6gwe:
Crystal structure of Thrombin bound to P2 macrocycle