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Yorodumi- ChemComp-1R3: N-{3-[dihydroxy(nonyl)-lambda~4~-sulfanyl]propyl}-N~3~-[(2R)-2-hy... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 1R3 |
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Name | Name: |
-Chemical information
Composition | Formula: C21H45N2O9PS / Number of atoms: 79 / Formula weight: 532.629 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 1R3 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4KEH | ||||
History |
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External links | UniChem / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | [( | |
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-PDB entries
Showing all 1 items
PDB-4keh:
Crosslinked Crystal Structure of Type II Fatty Synthase Dehydratase, FabA, and Acyl Carrier Protein, AcpP