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Open data
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Basic information
Entry | ![]() | ||
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Name | Name: Synonyms: (3ALPHA,5ALPHA,7BETA,8ALPHA,17ALPHA)-3,7-DIHYDROXYCHOLAN-24-OIC ACID Wikipedia | ![]() Chenodeoxycholic acid (CDCA; also known as chenodesoxycholic acid, chenocholic acid and 3α,7α-dihydroxy-5β-cholan-24-oic acid) is a bile acid. Salts of this carboxylic acid are called chenodeoxycholates... |
-Chemical information
Composition | |||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: JN3 / Ideal coordinates details: OpenEye/OEToolkits V1.4.2 | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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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 6 items
![](data/pdb/img/2jn3.jpg)
PDB-2jn3:
NMR structure of cl-BABP complexed to chenodeoxycholic acid
![](data/pdb/img/3o02.jpg)
PDB-3o02:
The Crystal Structure of the Salmonella Type III Secretion System Tip Protein SipD in Complex with Chenodeoxycholate
![](data/pdb/img/6hl1.jpg)
PDB-6hl1:
Crystal Structure of Farnesoid X receptor (FXR) with bound NCoA-2 peptide and CDCA
![](data/pdb/img/6ie9.jpg)
PDB-6ie9:
RamR in complex with chenodeoxycholic acid
![](data/pdb/img/7svg.jpg)
PDB-7svg:
Bile Salt Hydrolase A from Lactobacillus gasseri with chenodeoxycholate and taurine bound
![](data/pdb/img/8dml.jpg)
PDB-8dml:
Vibrio parahaemolyticus VtrA/VtrC complex bound to the bile salt chenodeoxycholate