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Yorodumi- ChemComp-MQQ: N-[(1S)-1-[({(1S)-3-PHENYL-1-[2-(PHENYLSULFONYL)ETHYL]PROPYL}AMIN... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: MQQ |
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Name | Name: |
-Chemical information
Composition | Formula: C32H39N3O7S2 / Number of atoms: 83 / Formula weight: 641.798 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: MQQ / Model coordinates PDB-ID: 2G6D | ||||
History |
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External links | UniChem / ChemSpider / PubChem / ZINC / 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-2g6d:
Human cathepsin S mutant with vinyl sulfone inhibitor CRA-14009