CHEBI:17263 - estrone

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ChEBI Name estrone
ChEBI ID CHEBI:17263
Definition A 17-oxo steroid that is estra-1,3,5(10)-triene substituted by an hydroxy group at position 3 and an oxo group at position 17.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:14220, CHEBI:23971, CHEBI:4870
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Formula C18H22O2
Net Charge 0
Average Mass 270.36608
Monoisotopic Mass 270.16198
InChI InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1
InChIKey DNXHEGUUPJUMQT-CBZIJGRNSA-N
SMILES [H][C@]12CC[C@]3(C)C(=O)CC[C@@]3([H])[C@]1([H])CCc1cc(O)ccc21
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): estrogen
A hormone that stimulates or controls the development and maintenance of female sex characteristics in mammals by binding to oestrogen receptors. The oestrogens are named for their importance in the oestrous cycle. The oestrogens that occur naturally in the body, notably estrone, estradiol, estriol, and estetrol are steroids. Other compounds with oestrogenic activity are produced by plants (phytoestrogens) and fungi (mycoestrogens); synthetic compounds with oestrogenic activity are known as xenoestrogens.
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Application(s): bone density conservation agent
An agent that inhibits bone resorption and/or favor bone mineralization and bone regeneration. Used to heal bone fractures and to treat bone diseases such as osteopenia and osteoporosis.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing estrone (CHEBI:17263) has parent hydride estrane (CHEBI:23966)
estrone (CHEBI:17263) has role antineoplastic agent (CHEBI:35610)
estrone (CHEBI:17263) has role bone density conservation agent (CHEBI:50646)
estrone (CHEBI:17263) has role estrogen (CHEBI:50114)
estrone (CHEBI:17263) has role human metabolite (CHEBI:77746)
estrone (CHEBI:17263) has role mouse metabolite (CHEBI:75771)
estrone (CHEBI:17263) is a 17-oxo steroid (CHEBI:19168)
estrone (CHEBI:17263) is a 3-hydroxy steroid (CHEBI:36834)
estrone (CHEBI:17263) is a phenolic steroid (CHEBI:177917)
estrone (CHEBI:17263) is a phenols (CHEBI:33853)
Incoming 15α-hydroxyestrone (CHEBI:87618) has functional parent estrone (CHEBI:17263)
16α-hydroxyestrone (CHEBI:776) has functional parent estrone (CHEBI:17263)
16β-hydroxyestrone (CHEBI:87628) has functional parent estrone (CHEBI:17263)
2-hydroxyestrone (CHEBI:1156) has functional parent estrone (CHEBI:17263)
2-methoxyestrone (CHEBI:1189) has functional parent estrone (CHEBI:17263)
2-methoxyestrone 3-sulfate (CHEBI:1191) has functional parent estrone (CHEBI:17263)
4-hydroxyestrone (CHEBI:87602) has functional parent estrone (CHEBI:17263)
4-methoxyestrone (CHEBI:136972) has functional parent estrone (CHEBI:17263)
6α-hydroxyestrone (CHEBI:87605) has functional parent estrone (CHEBI:17263)
6β-hydroxyestrone (CHEBI:87626) has functional parent estrone (CHEBI:17263)
estrone 3-O-(β-D-glucuronide) (CHEBI:28919) has functional parent estrone (CHEBI:17263)
estrone 3-sulfate (CHEBI:17474) has functional parent estrone (CHEBI:17263)
estrone sodium sulfate (CHEBI:8389) has functional parent estrone (CHEBI:17263)
estropipate (CHEBI:4873) has functional parent estrone (CHEBI:17263)
IUPAC Name
3-hydroxyestra-1,3,5(10)-trien-17-one
INN Source
estrone DrugBank
Synonyms Sources
3-Hydroxy-1,3,5(10)-estratrien-17-one KEGG COMPOUND
Estrone KEGG COMPOUND
estrone UniProt
follicular hormone NIST Chemistry WebBook
folliculin NIST Chemistry WebBook
oestrone NIST Chemistry WebBook
Manual Xrefs Databases
3188 DrugCentral
C00003663 KNApSAcK
C00468 KEGG COMPOUND
D00067 KEGG DRUG
DB00655 DrugBank
Estrone Wikipedia
FR1305992 Patent
HMDB0000145 HMDB
J3Z PDBeChem
LMST02010004 LIPID MAPS
LSM-3837 LINCS
US1967350 Patent
US1967351 Patent
View more database links
Registry Numbers Types Sources
1915077 Reaxys Registry Number Reaxys
53-16-7 CAS Registry Number KEGG COMPOUND
53-16-7 CAS Registry Number ChemIDplus
53-16-7 CAS Registry Number NIST Chemistry WebBook
542591 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
11786692 PubMed citation Europe PMC
13908815 PubMed citation Europe PMC
15784278 PubMed citation Europe PMC
17447557 PubMed citation Europe PMC
19610377 PubMed citation Europe PMC
23647561 PubMed citation Europe PMC
24390165 PubMed citation Europe PMC
24398390 PubMed citation Europe PMC
Last Modified
19 September 2022