CHEBI:62847 - 6α-hydroxy-17β-estradiol

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ChEBI Name 6α-hydroxy-17β-estradiol ChEBI ID CHEBI:62847 ChEBI ASCII Name 6alpha-hydroxy-17beta-estradiol Definition A 4-hydroxy steroid that consists of 17β-estradiol bearing an additional 6α-hydroxy substituent. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H24O3 Net Charge 0 Average Mass 288.38140 Monoisotopic Mass 288.17254 InChI InChI=1S/C18H24O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15-17,19-21H,4-7,9H2,1H3/t12-,13-,15+,16+,17+,18+/m1/s1 InChIKey QZZRQURPSRWTLG-WOVZSMEKSA-N SMILES [H][C@]12CC[C@]3(C)[C@@H](O)CC[C@@]3([H])[C@]1([H])C[C@H](O)c1cc(O)ccc21 ChEBI Ontology Outgoing 6α-hydroxy-17β-estradiol (CHEBI:62847) has functional parent 17β-estradiol (CHEBI:16469) 6α-hydroxy-17β-estradiol (CHEBI:62847) is a 6α-hydroxy steroid (CHEBI:36850) IUPAC Name estra-1,3,5(10)-triene-3,6α,17β-triol Synonyms Sources 6α-hydroxy-17β-estradiol UniProt 6α-hydroxyestradiol ChEBI Citation Type Source 11812141 PubMed citation Europe PMC Last Modified 29 September 2016