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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5β-pregnane-3β,20α-diol
ChEBI ID CHEBI:156526
ChEBI ASCII Name 5beta-pregnane-3beta,20alpha-diol
Stars This entity has been manually annotated by a third party.
Submitter Lucila Aimo
Supplier Information
Download Molfile XML SDF
Formula C21H36O2
Net Charge 0
Average Mass 320.517
Monoisotopic Mass 320.27153
InChI InChI=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
InChIKey YWYQTGBBEZQBGO-HUTKLZKUSA-N
SMILES C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@@]2(C[C@H](C1)O)[H])[H])(CC[C@]4([H])[C@@H](O)C)[H])C)[H])C
Roles Classification
Biological Role(s): 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.
(via steroid hormone )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 Pregnanediol (CHEBI:8387) is tautomer of 5β-pregnane-3β,20α-diol (CHEBI:156526)
Synonyms Sources
(3β,5β,20α)-Pregnane-3,20-diol SUBMITTER
3β,20α-dihydroxy-5β-pregnane UniProt
Citation Waiting for Citations Type Source
10998348 PubMed citation SUBMITTER