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Yorodumi- ChemComp-XX6: 2-{[(2R)-2-HYDROXY-3-(9-PHENANTHRYLOXY)PROPYL]AMINO}PROPANE-1,3-DIOL -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: XX6 |
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Name | Name: Synonyms: (R)-DIHYDROXY-PHENANTHRENOLOL |
-Chemical information
Composition | Formula: C20H23NO4 / Number of atoms: 48 / Formula weight: 341.401 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: XX6 / Ideal coordinates details: Corina V3.40 | ||||||
History |
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External links | UniChem / ChemSpider / Brenda / Nikkaji / 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-2v3i:
Hypocrea jecorina Cel7A in complex with (R)-dihydroxy-phenanthrenolol