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Yorodumi- ChemComp-W0T: (2~{S})-3-(1~{H}-indol-3-yl)-2-[2,2,3,3,4,4,5,5,6,6,7,7,7-trideca... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: W0T |
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Name | Name: ( |
-Chemical information
Composition | Formula: C18H11F13N2O3 / Number of atoms: 47 / Formula weight: 550.271 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: W0T / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5B2X | ||||
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
CACTVS 3.385 | OpenEye OEToolkits 2.0.4 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.4 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.4 | ( |
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-PDB entries
Showing all 1 items
PDB-5b2x:
Crystal Structure of P450BM3 mutant with N-perfluoroheptanoyl-L-tryptophan