5-Androstene-3b,16a,17a-triol

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==Description==
==Description==
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[http://172.141.127.22/raghava/hmrbase/test_extract.php?db=arun&table=nphormonet&id=1134&show=SHOW-3D Show 3-D Structure]
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5-Androstene-3b,16a,17a-triol is a normal urinary steroid in newborn infants (PMID 14709852), in the mono- and disulfate fractions of human bile (PMID 5410667), and was found in the blood of a patient with paraquat poisoning (PMID 7094338)
5-Androstene-3b,16a,17a-triol is a normal urinary steroid in newborn infants (PMID 14709852), in the mono- and disulfate fractions of human bile (PMID 5410667), and was found in the blood of a patient with paraquat poisoning (PMID 7094338)
==General Properties==
==General Properties==
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Current revision

Contents

[edit] Description

Show 3-D Structure

5-Androstene-3b,16a,17a-triol is a normal urinary steroid in newborn infants (PMID 14709852), in the mono- and disulfate fractions of human bile (PMID 5410667), and was found in the blood of a patient with paraquat poisoning (PMID 7094338)

[edit] General Properties

*Molecular Weight

306.44

*Molecular Formula

C19H30O3

*IUPAC NAME

(3b,16a,17a)-androst-5-ene-3,16,17-triol

*Canonical Smiles

CC12CCC3C(CC=C4CC(O)CCC34C)C1CC(O)C2O

*Isomeric Smiles

C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1C[C@@H](O)[C@H]2O


[edit] PhysioChemical Properties

*Melting Point


*LogP


*Water Solubility


[edit] External Links

  • [1]Human Metabolome DataBase