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CHEBI:34475 - 6alpha-Methylpregn-4-ene-3,11,20-trione

ChEBI IDCHEBI:34475
ChEBI Name6alpha-Methylpregn-4-ene-3,11,20-trione
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H30O3
Net Charge0
Average Mass342.479
Monoisotopic Mass342.21949
SMILES[H][C@@]12C[C@H](C)C3=CC(=O)CC[C@]3(C)[C@@]1([H])C(=O)C[C@]1(C)[C@@H](C(C)=O)CC[C@@]21[H]
InChIInChI=1S/C22H30O3/c1-12-9-15-17-6-5-16(13(2)23)22(17,4)11-19(25)20(15)21(3)8-7-14(24)10-18(12)21/h10,12,15-17,20H,5-9,11H2,1-4H3/t12-,15-,16+,17-,20+,21-,22+/m0/s1
InChIKeyNUSUWEUUEXDJDY-CMYFSFSVSA-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)
6alpha-Methylpregn-4-ene-3,11,20-trione (CHEBI:34475) is a corticosteroid hormone (CHEBI:36699)
Synonyms  Source
6alpha-Methylpregn-4-ene-3,11,20-trioneKEGG COMPOUND
6alpha-Methyl-11-oxoprogesteroneKEGG COMPOUND
SKI22936KEGG COMPOUND
Manual XrefsDatabases
C14632KEGG COMPOUND
Registry NumbersSources
CAS:3642-85-1KEGG COMPOUND