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==Description==
[http://172.141.127.22/raghava/hmrbase/test_extract.php?db=arun&table=nphormonet&id=1166&show=SHOW-3D Show 3-D Structure]

found in urine of newborn infants
==General Properties==

<b>*Molecular Weight</b>

348.48

<b>*Molecular Formula</b>

C<sub>2</sub><sub>1</sub>H<sub>3</sub><sub>2</sub>O<sub>4</sub>

<b>*IUPAC NAME</b>

1-[(3S,8R,9S,10R,13S,14S,15R,17R)-3,15,17-trihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone

<b>*Canonical Smiles</b>

CC(=O)C1(CC(C2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O)O

<b>*Isomeric Smiles</b>

CC(=O)[C@]1(C[C@H]([C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)O)O


==PhysioChemical Properties==

<b>*Melting Point</b>



<b>*LogP</b>



<b>*Water Solubility</b>



==External Links==
*[http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=133455]Pubchem
*[http://www.hmdb.ca/metabolites/HMDB00353]Human Metabolome DataBase

[[Category:Hormones]]
[[Category:HMRbase]]