CHEBI:173191 - 16-Oxoandrostenediol

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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 16-Oxoandrostenediol
ChEBI ID CHEBI:173191
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H28O3
Net Charge 0
Average Mass 304.430
Monoisotopic Mass 304.20384
InChI InChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-15,17,20,22H,4-10H2,1-2H3/t12-,13+,14-,15-,17-,18-,19-/m0/s1
InChIKey AKRBLZKRYPEVIK-PEMPUTJUSA-N
SMILES O[C@@H]1[C@@]2([C@]([C@]3([C@@]([C@@]4(C(=CC3)C[C@@H](O)CC4)C)(CC2)[H])[H])(CC1=O)[H])C
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) Found in feces (BTO:0000440). See: MetaboLights Study
Roles Classification
Biological Role(s): androgen
A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
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ChEBI Ontology
Outgoing 16-Oxoandrostenediol (CHEBI:173191) has role androgen (CHEBI:50113)
16-Oxoandrostenediol (CHEBI:173191) is a 3-hydroxy steroid (CHEBI:36834)
IUPAC Name
(3S,8R,9S,10R,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one
Manual Xrefs Databases
132993 ChemSpider
LMST02020088 LIPID MAPS
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Registry Number Type Source
1159-66-6 CAS Registry Number ChemIDplus