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CHEBI:135844 - selenium (75Se) tauroselcholic acid

ChEBI IDCHEBI:135844
ChEBI Nameselenium (75Se) tauroselcholic acid
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC26H45NO7S
Net Charge0
Average Mass590.636
Monoisotopic Mass590.21420
SMILES[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)C[75Se]CC(=O)NCCS(=O)(=O)O)[C@]1([H])[C@H](O)C2
InChIInChI=1S/C26H45NO7SSe/c1-15(13-36-14-23(31)27-8-9-35(32,33)34)18-4-5-19-24-20(12-22(30)26(18,19)3)25(2)7-6-17(28)10-16(25)11-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1/i36-4
InChIKeyJCMLWGQJPSGGEI-DJQDYNOGSA-N
Roles Classification
Biological Role:
hormone  Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
ChEBI Ontology
Outgoing Relation(s)
selenium (75Se) tauroselcholic acid (CHEBI:135844) is a corticosteroid hormone (CHEBI:36699)
Manual XrefsDatabases
4059DrugCentral
Registry NumbersSources
CAS:75018-70-1DrugCentral