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CHEBI:79807 - 9-Chloro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate

ChEBI IDCHEBI:79807
ChEBI Name9-Chloro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate
Stars
DownloadsMolfile
FormulaC23H31ClO6
Net Charge0
Average Mass438.948
Monoisotopic Mass438.18092
SMILES[H][C@@]12CC[C@](O)(C(=O)COC(C)=O)[C@@]1(C)C[C@H](O)[C@@]1(Cl)[C@@]2([H])CCC2=CC(=O)CC[C@@]21C
InChIInChI=1S/C23H31ClO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h10,16-18,27,29H,4-9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1
InChIKeyHTJFRKHNCHTUNL-GSLJADNHSA-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)
9-Chloro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate (CHEBI:79807) is a corticosteroid hormone (CHEBI:36699)
Synonyms  Source
9-Chloro-17-hydroxycorticosterone 21-acetateKEGG COMPOUND
9alpha-Chlorocortisol acetateKEGG COMPOUND
Manual XrefsDatabases
C15305KEGG COMPOUND