Revision as of 09:48, 20 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,074 edits Saving copy of the {{chembox}} taken from revid 474177210 of page Sinistrin for the Chem/Drugbox validation project (updated: 'DrugBank', 'UNII', 'CASNo').← Previous edit |
Revision as of 09:48, 20 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,074 edits Saving copy of the {{chembox}} taken from revid 472266447 of page Skatole for the Chem/Drugbox validation project (updated: 'ChEBI').Next edit → |
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} |
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} |
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{{chembox |
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{{chembox |
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| verifiedrevid = 472264898 |
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| ImageFile = Sinistrin.svg |
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| Name = Skatole |
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| ImageCaption = Example chemical structure of sinistrin |
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| ImageFileL1 = Skatole structure.svg |
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| OtherNames = |
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| ImageSizeL1 = 120px |
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Polyfructosan |
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| ImageFileR1= Skatole_3d_structure.png |
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* Polyfructosan-S |
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| ImageSizeR2 = 120px |
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* Inulin analogue |
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| ImageName = Skatole |
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* Inutest |
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| IUPACName = 3-methylindole |
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| OtherNames = 4-Methyl-2,3-benzopyrrole |
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| Section1 = {{Chembox Identifiers |
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| Section1 = {{Chembox Identifiers |
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| UNII_Ref = {{fdacite|correct|FDA}} |
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| DrugBank = <!-- blanked - oldvalue: DB00638 --> |
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| UNII = 9W945B5H7R |
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| UNII = <!-- blanked - oldvalue: JOS53KRJ01 --> |
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| SMILES = C1=C2C(=CC=C1)C(=C2C)C |
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| PubChem = |
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| CASNo_Ref = {{cascite|correct|CAS}} |
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| ChEMBL = |
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| CASNo = <!-- blanked - oldvalue: 37311-25-4 --> |
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| CASNo = 83-34-1 |
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| ChemSpiderID = NA |
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| RTECS = |
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| ChEBI = 9171 |
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| ATC-Code = {{ATC|V04|CH01}} |
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| PubChem = 6736 |
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| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
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| ChemSpiderID = 6480 |
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| SMILES = c1cccc2c1c(cn2)C |
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| InChI = 1/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3 |
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| InChIKey = ZFRKQXVRDFCRJG-UHFFFAOYAZ |
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| StdInChI_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChI = 1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3 |
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| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChIKey = ZFRKQXVRDFCRJG-UHFFFAOYSA-N |
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}} |
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}} |
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| Section2 = {{Chembox Properties |
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| Section2 = {{Chembox Properties |
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| C=9|H=9|N=1 |
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| Formula = (C<sub>6</sub>H<sub>10</sub>O<sub>6</sub>)<sub>n</sub> |
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| Appearance = White crystalline solid |
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| MolarMass= |
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| Solubility= |
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| Density = |
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| Solubility = Insoluble |
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good in water<ref name="Hoppe-Seyler"/> |
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| MeltingPtCL = 93 |
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* not soluble in ]<ref name="Schmiedeberg">O. Schmiedeberg: '''' Hoppe-Seyler´s Zeitschrift für physiologische Chemie, Band 3 (1-2), 1879. {{doi|10.1515/bchm1.1879.3.1-2.112}}.</ref> |
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| MeltingPtCL = 95 |
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| Density= |
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| BoilingPtC = 265 |
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| MeltingPt= |
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| pKa = |
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| BoilingPt= <!-- 160–170 °C<ref name="Hoppe-Seyler"/> This boiling point is dubious. Should it be the melting point? --> |
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| pKb = |
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| Viscosity = |
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}} |
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| Section3 = {{Chembox Structure |
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| MolShape = |
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| Coordination = |
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| CrystalStruct = |
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| Dipole = |
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}} |
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| Section7 = {{Chembox Hazards |
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| MainHazards = |
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| FlashPt = |
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| RPhrases = |
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| SPhrases = |
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}} |
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| Section8 = {{Chembox Related |
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| OtherAnions = |
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| OtherCations = |
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| Function = |
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| OtherFunctn = |
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| OtherCpds = |
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}} |
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}} |
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}} |
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}} |