CHEBI:192671 - Trenbolone acetate

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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 Trenbolone acetate
ChEBI ID CHEBI:192671
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H24O3
Net Charge 0
Average Mass 312.409
Monoisotopic Mass 312.17254
InChI InChI=1S/C20H24O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h9-11,17-19H,3-8H2,1-2H3/t17-,18+,19+,20+/m1/s1
InChIKey CMRJPMODSSEAPL-FYQPLNBISA-N
SMILES O([C@@H]1[C@@]2([C@]([C@]3(C(C=C2)=C4C(CC3)=CC(=O)CC4)[H])(CC1)[H])C)C(=O)C
Metabolite of Species Details
Valsa sordida (NCBI:txid252740) Found in Whole Organism (NCIT:C13413). See: MetaboLights Study
ChEBI Ontology
Outgoing Trenbolone acetate (CHEBI:192671) is a steroid ester (CHEBI:47880)
IUPAC Name
[(8S,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Manual Xrefs Databases
59737 ChemSpider
D06211 KEGG DRUG
View more database links
Registry Number Type Source
10161-34-9 CAS Registry Number ChemIDplus