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CHEBI:156526 - 5β-pregnane-3β,20α-diol

Default Structure
ChEBI IDCHEBI:156526
ChEBI Name5β-pregnane-3β,20α-diol
Stars
ASCII Name5beta-pregnane-3beta,20alpha-diol
Submitterlaimo
DownloadsMolfile
FormulaC21H36O2
Net Charge0
Average Mass320.517
Monoisotopic Mass320.27153
SMILES[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)O)[C@@]1(C)CC[C@H](O)C2
InChIInChI=1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13-,14+,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKeyYWYQTGBBEZQBGO-HUTKLZKUSA-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)
5β-pregnane-3β,20α-diol (CHEBI:156526) has functional parent 3β-hydroxy-5β-pregnan-20-one (CHEBI:16229)
5β-pregnane-3β,20α-diol (CHEBI:156526) is a corticosteroid hormone (CHEBI:36699)
5β-pregnane-3β,20α-diol (CHEBI:156526) is tautomer of Pregnanediol (CHEBI:8387)
Incoming Relation(s)
Pregnanediol (CHEBI:8387) is tautomer of 5β-pregnane-3β,20α-diol (CHEBI:156526)
Synonym  Source
(3β,5β,20α)-Pregnane-3,20-diolSUBMITTER
UniProt Name  Source
3β,20α-dihydroxy-5β-pregnaneUniProt
Citations