3alpha-(Sulfonatooxy)-5beta-cholan-24-oate (BioCAD00000173344)

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Metabolite Card

Formula: C24H38O6S (454.2389)
SMILES: [H][C@@](C)(CCC([O-])=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@]([H])(CC[C@]4(C)[C@@]3([H])CC[C@]12C)OS([O-])(=O)=O

Synonyms [en]

3Α-(sulphonatooxy)-5β-cholan-24-Oic acid; 3Α-(sulfonatooxy)-5β-cholan-24-Oate; (3alpha,5beta)-3-(Sulphonatooxy)cholan-24-Oic acid; Lithocholic acid 3-sulfuric acid(2-); (3alpha,5beta)-3-(Sulfonatooxy)cholan-24-Oic acid; Sulfolithocholic acid(2-)

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

3alpha-(Sulfonatooxy)-5beta-cholan-24-oate. 数据之源，洞见之始. SMRUCC genomics institute, a synthetic life researcher from China. https://biocad_registry.innovation.ac.cn/s/(-)-arctiin (retrieved 2026-01-03) (CAD Registry RN: BioCAD00000173344). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

Entity Information

DBLinks

Other DBLinks
  • PubChem: 122391354
  • ChEBI: ChEBI:133940
  • HMDB: HMDB0242165

Class / Ontology

Metabolic Network
ID EC Number Name
Rhea:RHEA:51065 lithocholate + 3'-phosphoadenylyl sulfate => lithocholate sulfate + adenosine 3',5'-bisphosphate + H+
Rhea:RHEA:51066 lithocholate sulfate + adenosine 3',5'-bisphosphate + H+ => lithocholate + 3'-phosphoadenylyl sulfate
Rhea:RHEA:51067 lithocholate + 3'-phosphoadenylyl sulfate <=> lithocholate sulfate + adenosine 3',5'-bisphosphate + H+
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Organism Source

Taxonomy Source

Pathway Synthetic

pathway id name
Reactome:R-BTA-1430728 Metabolism
Reactome:R-CEL-211859 Biological oxidations
Reactome:R-CEL-156584 Cytosolic sulfonation of small molecules
Reactome:R-DRE-156584 Cytosolic sulfonation of small molecules
Reactome:R-GGA-156580 Phase II - Conjugation of compounds
Reactome:R-HSA-211859 Biological oxidations
Reactome:R-MMU-1430728 Metabolism
Reactome:R-MMU-211859 Biological oxidations
Reactome:R-XTR-156584 Cytosolic sulfonation of small molecules
Reactome:R-BTA-211859 Biological oxidations
Reactome:R-GGA-156584 Cytosolic sulfonation of small molecules
Reactome:R-HSA-156580 Phase II - Conjugation of compounds
Reactome:R-MMU-156580 Phase II - Conjugation of compounds
Reactome:R-RNO-211859 Biological oxidations
Reactome:R-SSC-1430728 Metabolism
Reactome:R-SSC-211859 Biological oxidations
Reactome:R-BTA-156584 Cytosolic sulfonation of small molecules
Reactome:R-CEL-156580 Phase II - Conjugation of compounds
Reactome:R-DRE-1430728 Metabolism
Reactome:R-DRE-156580 Phase II - Conjugation of compounds
View All Pathways