CHEBI:87593 - 15α-hydroxyestradiol

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ChEBI Name 15α-hydroxyestradiol
ChEBI ASCII Name 15alpha-hydroxyestradiol
Definition A 3-hydroxy steroid that is 17β-estradiol substituted by an α-hydroxy group at position 15.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C18H24O3
Net Charge 0
Average Mass 288.382
Monoisotopic Mass 288.17254
InChI InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)17(18)15(20)9-16(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,17-,18-/m1/s1
SMILES C1=C2C(CC[C@]3([C@@]4([C@H](C[C@@H]([C@]4(CC[C@@]32[H])C)O)O)[H])[H])=CC(=C1)O
Metabolite of Species Details
Petromyzon marinus (NCBI:txid7757) See: PubMed
Homo sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 15α-hydroxyestradiol (CHEBI:87593) has functional parent 17β-estradiol (CHEBI:16469)
15α-hydroxyestradiol (CHEBI:87593) has parent hydride estrane (CHEBI:23966)
15α-hydroxyestradiol (CHEBI:87593) has role human xenobiotic metabolite (CHEBI:76967)
15α-hydroxyestradiol (CHEBI:87593) has role marine xenobiotic metabolite (CHEBI:83399)
15α-hydroxyestradiol (CHEBI:87593) is a 15α-hydroxy steroid (CHEBI:83147)
15α-hydroxyestradiol (CHEBI:87593) is a 17β-hydroxy steroid (CHEBI:35343)
15α-hydroxyestradiol (CHEBI:87593) is a 3-hydroxy steroid (CHEBI:36834)
15α-hydroxyestradiol (CHEBI:87593) is a phenols (CHEBI:33853)
Synonyms Sources
(15α,17β)-estra-1(10),2,4-triene-3,15,17-triol IUPAC
15α-hydroxy-17β-estradiol UniProt
15alpha-Hydroxyestradiol ChemIDplus
3,15α,17β-trihydroxyestra-1,3,5(10)-triene ChEBI
Estra-1,3,5(10)-triene-3,15alpha,17-triol ChemIDplus
Estra-1,3,5(10)-triene-3,15alpha,17beta-triol NIST Chemistry WebBook
estra-1,3,5(10)-triene-3,15α,17β-triol SUBMITTER
Registry Numbers Types Sources
2622735 Reaxys Registry Number Reaxys
570-30-9 CAS Registry Number ChemIDplus
570-30-9 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
12011817 PubMed citation Europe PMC
12865317 PubMed citation SUBMITTER
150071 PubMed citation Europe PMC
15193266 PubMed citation Europe PMC
4559652 PubMed citation Europe PMC
630454 PubMed citation Europe PMC
956337 PubMed citation Europe PMC
Last Modified
14 June 2018