5alpha-Cholestan-3-one

From DrugPedia: A Wikipedia for Drug discovery

Revision as of 07:12, 13 February 2009 (edit) Raghavagps (Talk | contribs) m (1 revision) ← Previous diff		Current revision (04:03, 11 December 2009) (edit) (undo) Gaurav (Talk | contribs)
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	==Description==		==Description==
		+	[http://172.141.127.22/raghava/hmrbase/test_extract.php?db=arun&table=nphormonet&id=1138&show=SHOW-3D Show 3-D Structure]
	==General Properties==		==General Properties==
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Current revision

Contents 1 Description 2 General Properties 3 PhysioChemical Properties 4 External Links

[edit] Description

Show 3-D Structure

[edit] General Properties

*Molecular Weight

386.65

*Molecular Formula

C₂₇H₄₆O

*IUPAC NAME

(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

*Canonical Smiles

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C

*Isomeric Smiles

CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C

[edit] PhysioChemical Properties

*Melting Point

*LogP

*Water Solubility

[edit] External Links

• [1]Pubchem
• [2]KEGG Compound
• [3]Human Metabolome DataBase