16-Oxoandrostenediol
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[edit] Description
synthesized by hepatic microsomes from previable and anencephalic human fetuses; abundant steroid of umbilical cord blood and the physiologic precursor for 16-ketoestradiol-17 beta; major urinary estrogen of human pregnancy; structure
[edit] General Properties
*Molecular Weight
304.42
*Molecular Formula
C19H28O3
*IUPAC NAME
(3S,8R,9S,10R,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one
*Canonical Smiles
CC12CCC(CC1=CCC3C2CCC4(C3CC(=O)C4O)C)O
*Isomeric Smiles
C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC(=O)[C@@H]4O)C)O
[edit] PhysioChemical Properties
*Melting Point
*LogP
*Water Solubility