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Chenodeoxycholate

CHEBI:CHEBI_36234

Definition

Conjugate base of chenodeoxycholic acid; major species at pH 7.3.

Chemical Information

Molecular Formula
C24H39O4
Molecular Mass
391.56406
Charge
-1
SMILES
[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCC([O-])=O
InChI
InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/p-1/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
InChIKey
RUDATBOHQWOJDD-BSWAIDMHSA-M

Alternative Names

  • 3alpha,7alpha-dihydroxy-5beta-cholan-24-oate
  • chenodeoxycholate
  • chenodeoxycholate anion
  • chenodeoxycholate(1-)

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
42588
oboInOwl#hasDbXref
Beilstein:3703074
core#notation
CHEBI:36234

Additional References

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Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
42588
oboInOwl#hasDbXref
Beilstein:3703074
oboInOwl#hasAlternativeId
CHEBI:57884
oboInOwl#id
CHEBI:36234
core#notation
CHEBI:36234
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_77746
chebi#is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_16755
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
chebi#is_conjugate_acid_of
http://purl.obolibrary.org/obo/CHEBI_16755
owl#someValuesFrom
t1020396
owl#annotatedSource
t204118