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Ononitol: Difference between revisions

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Revision as of 18:03, 10 September 2011 editCheMoBot (talk | contribs)Bots141,565 edits Updating {{chembox}} (no changed fields - added verified revid - updated 'DrugBank_Ref', 'UNII_Ref', 'ChEMBL_Ref', 'KEGG_Ref') per Chem/Drugbox validation (report errors or [[user talk:CheMoBo← Previous edit Revision as of 14:10, 13 May 2015 edit undoWildCation (talk | contribs)Extended confirmed users2,163 edits Changes SMILES in Chembox to one with stereochemistry.Next edit →
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| ChEBI_Ref = {{ebicite|correct|EBI}} | ChEBI_Ref = {{ebicite|correct|EBI}}
| ChEBI = 18266 | ChEBI = 18266
| SMILES = COC1C(C(C(C(C1O)O)O)O)O | SMILES = CO1((((1O)O)O)O)O
| InChI = 1/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2-,3-,4-,5+,6-,7-/m0/s1 | InChI = 1/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2-,3-,4-,5+,6-,7-/m0/s1
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}

Revision as of 14:10, 13 May 2015

Ononitol
Names
IUPAC name (1R,2S,3S,4S,5S,6S)-6-Methoxycyclohexane-1,2,3,4,5-pentaol
Other names 4-O-Methyl-myo-inositol
Identifiers
3D model (JSmol)
ChEBI
ChemSpider
CompTox Dashboard (EPA)
InChI
  • InChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2-,3-,4-,5+,6-,7-/m0/s1Key: DSCFFEYYQKSRSV-GESKJZQWSA-N
  • InChI=1/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2-,3-,4-,5+,6-,7-/m0/s1
SMILES
  • CO1((((1O)O)O)O)O
Properties
Chemical formula C7H14O6
Molar mass 194.183 g·mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkverify (what is  ?) Infobox references
Chemical compound

Ononitol is a cyclitol. It is a 4-O-methyl-myo-inositol and is a constituent of Medicago sativa.

References

  1. E. A. McComb and V. V. Rendig (1962). "Ononitol (4-O-methyl-myo-inositol) as a constituent of Medicago sativa". Archives of Biochemistry and Biophysics. 99 (1): 192–193. doi:10.1016/0003-9861(62)90261-8.


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