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Yorodumi- ChemComp-XCF: 5-[[(2R)-2-cyclopropyl-7,8-dimethoxy-2H-chromen-5-yl]methyl]pyrim... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: XCF |
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Name | Name: |
-Chemical information
Composition | Formula: C19H22N4O3 / Number of atoms: 48 / Formula weight: 354.403 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: XCF / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3FRF | ||||||
History |
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External links | BindingDB / UniChem / Brenda / ChEBI / ChEMBL / DrugBank / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / 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 5 items
PDB-3frf:
S. aureus DHFR complexed with NADPH and iclaprim
PDB-3fy8:
Crystal Structure of Staph. aureus DHFR complexed with NADPH and AR-101
PDB-3fy9:
Staph. aureus DHFR F98Y complexed with AR-102
PDB-3fyv:
Staph. aureus DHFR complexed with NADPH and AR-102
PDB-3fyw:
Staph. aureus DHFR complexed with NADPH and AR-101