16alpha-Hydroxyestrone
From DrugPedia: A Wikipedia for Drug discovery
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*[http://www.hmdb.ca/metabolites/HMDB00335]Human Metabolome DataBase | *[http://www.hmdb.ca/metabolites/HMDB00335]Human Metabolome DataBase | ||
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Current revision
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Contents |
[edit] Description
[edit] General Properties
*Molecular Weight
286.37
*Molecular Formula
C18H22O3
*IUPAC NAME
(8S,9R,13S,14R,16R)-3,16-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
*Canonical Smiles
CC12CCC3C(C1CC(C2=O)O)CCC4=C3C=CC(=C4)O
*Isomeric Smiles
C[C@]12CC[C@@H]3[C@@H]([C@H]1C[C@H](C2=O)O)CCC4=C3C=CC(=C4)O
[edit] PhysioChemical Properties
*Melting Point
*LogP
*Water Solubility