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- ChemComp-BF0: methyl 4-{[(5beta,6alpha)-17-(cyclopropylmethyl)-3,14-dihydroxy-4... -
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Open data
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Basic information
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Name | Name: Synonyms: beta-funaltrexamine, bound form Wikipedia | ![]() β-Funaltrexamine is an irreversible (covalently bonding) opioid antagonist that was used to create the first crystal structure of the μ-opioid receptor. Chemically, it is a naltrexone derivative with a methyl-fumaramide group in the 6-position. Comment | antagonist*YM | |
-Chemical information
Composition | |||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: BF0 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4DKL | ||||
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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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
![](data/pdb/img/4dkl.jpg)
PDB-4dkl:
Crystal structure of the mu-opioid receptor bound to a morphinan antagonist