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Yorodumi- ChemComp-7B2: 4-[12-[(1-chloranyl-5,6,7-trimethyl-pyrrolo[3,4-d]pyridazin-3-ium... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 7B2 |
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Name | Name: |
-Chemical information
Composition | Formula: C27H29ClN9O / Number of atoms: 67 / Formula weight: 531.032 / Formal charge: 1 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 7B2 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5LWR | ||||
History |
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External links | UniChem / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 |
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