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Yorodumi- ChemComp-MS3: N,N-[2,5-O-DIBENZYL-GLUCARYL]-DI-[VALINYL-AMINOMETHANYL-PYRIDINE] -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: MS3 |
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Name | Name: Synonyms: INHIBITOR MSA367 |
-Chemical information
Composition | Formula: C42H52N6O8 / Number of atoms: 108 / Formula weight: 768.898 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: MS3 / Model coordinates PDB-ID: 1EC3 | ||||||
History |
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External links | UniChem / BindingDB / DrugBank / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | (OpenEye OEToolkits 1.5.0 | ( | |
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-PDB entries
Showing all 1 items
PDB-1ec3:
HIV-1 protease in complex with the inhibitor MSA367