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20385 details
Primary information
ID20385
Pubchem ID115116
Name16a-Hydroxyestrone
Description16a-Hydroxyestrone or 16alpha-hydroxyestrone (16alpha-OH-E1 or 16a OHE1); or hydroxyestrone; is an endogenous steroidal estrogen and a major metabolite of estrone and estradiol. 16a-hydroxyestrone belongs to the class of organic compounds known as estrogens and derivatives.
Synonym16 alpha OHE;3;16alpha-Dihydroxy-1;3;5(10)-estratrien-17-one;3;16alpha-Dihydroxyestra-1;3;5(10)-trien-17-one;Estra-1;3;5(10)-triene-3;16alpha-diol-17-one;16 a OHE;16 Α ohe;3;16a-Dihydroxy-1;3;5(10)-es
Molecular Weight286.3655
FormulaC18H22O3
IUPAC(1S;10R;11S;13R;15S)-5;13-dihydroxy-15-methyltetracyclo[8.7.0.0^{2;7}.0^{11;15}]heptadeca-2(7);3;5-trien-14-one
SMILE[H][C@@]12C[C@@H](O)C(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3
PDB IDNA
KEGGC05300
HMDB IDHMDB0000335
Melting Point (Degree C)NA
Water SolubilityNA
Drugbank IDNA
ReceptorNA
ReferenceHMDB