1,25-dihydroxyvitamin D3-26,23-lactone
From DrugPedia: A Wikipedia for Drug discovery
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==Description== | ==Description== | ||
+ | [http://crdd.osdd.net/raghava/hmrbase/test_extract.php?&db=arun&table=nphormonet&id=1237&show=SHOW-3D Show 3-D Structure] | ||
==General Properties== | ==General Properties== | ||
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Current revision
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Contents |
[edit] Description
[edit] General Properties
*Molecular Weight
444.6
*Molecular Formula
C27H40O5
*IUPAC NAME
(3R,5S)-5-[(2R)-2-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]propyl]-3-hydroxy-3-methyloxolan-2-one
*Canonical Smiles
CC(CC1CC(C(=O)O1)(C)O)C2CCC3C2(CCCC3=CC=C4CC(CC(C4=C)O)O)C
*Isomeric Smiles
C[C@H](C[C@H]1C[C@@](C(=O)O1)(C)O)[C@H]2CC[C@@H]3[C@@]2(CCC/C3=CC=C/4C[C@H](C[C@@H](C4=C)O)O)C
[edit] PhysioChemical Properties
*Melting Point
*LogP
*Water Solubility