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CHEBI:79488 - 11alpha-Hydroxy-12alpha-methyl-pregn-4-ene-3,20-dione

Default Structure
ChEBI IDCHEBI:79488
ChEBI Name11alpha-Hydroxy-12alpha-methyl-pregn-4-ene-3,20-dione
Stars
DownloadsMolfile
FormulaC22H32O3
Net Charge0
Average Mass344.495
Monoisotopic Mass344.23514
SMILES[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@H](O)[C@H](C)[C@]1(C)[C@@H](C(C)=O)CC[C@]12[H]
InChIInChI=1S/C22H32O3/c1-12-20(25)19-16(18-8-7-17(13(2)23)22(12,18)4)6-5-14-11-15(24)9-10-21(14,19)3/h11-12,16-20,25H,5-10H2,1-4H3/t12-,16-,17+,18-,19+,20+,21-,22+/m0/s1
InChIKeyJLOPYNSMWUXMEO-FJKSHLSCSA-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)
11alpha-Hydroxy-12alpha-methyl-pregn-4-ene-3,20-dione (CHEBI:79488) is a corticosteroid hormone (CHEBI:36699)
Manual XrefsDatabases
C14964KEGG COMPOUND