20:5 Cholesteryl ester

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==Description==
==Description==
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[http://crdd.osdd.net/raghava/hmrbase/test_extract.php?&db=arun&table=nphormonet&id=1316&show=SHOW-3D Show 3-D Structure]
==General Properties==
==General Properties==
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[[Categories:Hormones]]
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[[Category:Hormones]]
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[[Category:HMRbase]]

Current revision

Contents

[edit] Description

Show 3-D Structure

[edit] General Properties

*Molecular Weight

671.09

*Molecular Formula

C47H74O2

*IUPAC NAME

[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl](5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

*Canonical Smiles

CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

*Isomeric Smiles

CCC=C/CC=C/CC=C/CC=C/CC=C/CCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C


[edit] PhysioChemical Properties

*Melting Point


*LogP


*Water Solubility


[edit] External Links

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