CHEBI:1156 - 2-hydroxyestrone

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ChEBI Name 2-hydroxyestrone
ChEBI ID CHEBI:1156
Definition A 2-hydroxy steroid that is estrone substituted by a hydroxy group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H22O3
Net Charge 0
Average Mass 286.36548
Monoisotopic Mass 286.157
InChI InChI=1S/C18H22O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,19-20H,2-7H2,1H3/t11-,12+,14-,18-/m0/s1
InChIKey SWINWPBPEKHUOD-JPVZDGGYSA-N
SMILES [H][C@]12CC[C@]3(C)C(=O)CC[C@@]3([H])[C@]1([H])CCc1cc(O)c(O)cc21
Metabolite of Species Details
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-hydroxyestrone (CHEBI:1156) has functional parent estrone (CHEBI:17263)
2-hydroxyestrone (CHEBI:1156) has role human metabolite (CHEBI:77746)
2-hydroxyestrone (CHEBI:1156) is a 2-hydroxy steroid (CHEBI:36857)
Incoming estra-1(10),4-diene-2,3,17-trione (CHEBI:87262) has functional parent 2-hydroxyestrone (CHEBI:1156)
IUPAC Name
2,3-dihydroxyestra-1,3,5(10)-trien-17-one
Synonym Source
2-Hydroxyestrone KEGG COMPOUND
Database Links Databases
C05298 KEGG COMPOUND
HMDB00343 HMDB
LMST02010032 LIPID MAPS
View more database links
Registry Numbers Types Sources
2221833 Reaxys Registry Number Reaxys
362-06-1 CAS Registry Number KEGG COMPOUND
362-06-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11054642 PubMed citation CiteXplore
8337235 PubMed citation CiteXplore
Last Modified
23 October 2015