androsta-1,4-diene-3,11,17-trione (CHEBI:747464)

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CHEBI:747464 - androsta-1,4-diene-3,11,17-trione

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ChEBI ID	CHEBI:747464
ChEBI Name	androsta-1,4-diene-3,11,17-trione
Stars
Last Modified	23 March 2026
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C19H22O3
Net Charge	0
Average Mass	298.382
Monoisotopic Mass	298.15689
SMILES	[H][C@@]12CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])C(=O)C[C@]1(C)C(=O)CC[C@@]21[H]
InChI	InChI=1S/C19H22O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-9,13-14,17H,3-6,10H2,1-2H3/t13-,14-,17+,18-,19-/m0/s1
InChIKey	RZACPWSZIQKVDY-IRIMSJTPSA-N

ChEBI Ontology

Outgoing Relation(s)
	androsta-1,4-diene-3,11,17-trione (CHEBI:747464) is a 11-oxo steroid (CHEBI:47787)
	androsta-1,4-diene-3,11,17-trione (CHEBI:747464) is a 17-oxo steroid (CHEBI:19168)
	androsta-1,4-diene-3,11,17-trione (CHEBI:747464) is a 3-oxo-Δ¹,Δ⁴-steroid (CHEBI:77166)

UniProt Name	Source
androsta-1,4-diene-3,11,17-trione	UniProt

Manual Xrefs	Databases
CPD-28020	MetaCyc

Citations