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CHEBI:190894 - 6b-Hydroxymethandienone

ChEBI IDCHEBI:190894
ChEBI Name6b-Hydroxymethandienone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O3
Net Charge0
Average Mass316.441
Monoisotopic Mass316.20384
SMILES[H][C@@]12C[C@@H](O)C3=CC(=O)C=C[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1(C)O
InChIInChI=1S/C20H28O3/c1-18-7-4-12(21)10-16(18)17(22)11-13-14(18)5-8-19(2)15(13)6-9-20(19,3)23/h4,7,10,13-15,17,22-23H,5-6,8-9,11H2,1-3H3/t13-,14+,15+,17-,18-,19+,20+/m1/s1
InChIKeyOBCJFTMGLMNCTJ-INIPNLRTSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
Roles Classification
Biological Role:
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
ChEBI Ontology
Outgoing Relation(s)
6b-Hydroxymethandienone (CHEBI:190894) has role androgen (CHEBI:50113)
6b-Hydroxymethandienone (CHEBI:190894) is a 3-hydroxy steroid (CHEBI:36834)
IUPAC Name 
(6R,8R,9S,10R,13S,14S,17S)-6,17-dihydroxy-10,13,17-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
Manual XrefsDatabases
10363911ChemSpider
HMDB0005832HMDB
Registry NumbersSources
CAS:33526-41-9ChemIDplus