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Revision as of 13:21, 24 November 2011 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 453568185 of page N-Acetylneuraminic_acid for the Chem/Drugbox validation project (updated: 'ChEBI').← Previous edit Revision as of 13:22, 24 November 2011 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 453515484 of page N-Acetylserotonin for the Chem/Drugbox validation project (updated: 'ChEMBL', 'ChEBI', 'CASNo').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.}} {{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}}
{{Chembox {{Chembox
| verifiedrevid = 453566528 | verifiedrevid = 453514473
| Name=''N''-Acetylneuraminic acid | Name = ''N''-Acetylserotonin
| ImageFile = N-Acetylneuraminic acid.svg | ImageFile = N-Acetylserotonin.png
| ImageSize = | ImageSize =
| ImageFile2 = N-Acetylserotonin-3D-sticks.png
| IUPACName = 5-(acetylamino)-3,5-dideoxy-<small>D</small>-''glycero''-α-<small>D</small>-''galacto''-non-2-ulopyranosonic acid
| IUPACName = ''N''-acetamide
| OtherNames =
| OtherNames = ''N''-acetyl-5-hydroxytryptamine, ''N''-acetyl-5-HT
| Section1 = {{Chembox Identifiers | Section1 = {{Chembox Identifiers
| CASNo = 131-48-6 | CASNo = <!-- blanked - oldvalue: 1210-83-9 -->
| ChEBI = 61599 | ChEMBL = 33103
| PubChem = 439197 | ChEBI = 17697
| PubChem = 903
| SMILES = OC(=O)1(O)C(O)(NC(C)=O)(O1)(O)(O)CO
| SMILES = CC(=O)NCCC1=CNC2=C1C=C(C=C2)O
| MeSHName = N-Acetylneuraminic+Acid
| MeSHName = ''N''-Acetylserotonin
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID = 392681 | ChemSpiderID = 879
| InChI = 1/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,7+,8+,9+,11+/m0/s1 | InChI = 1/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)
| InChIKey = SQVRNKJHWKZAKO-YRMXFSIDBI | InChIKey = MVAWJSIDNICKHF-UHFFFAOYAX
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,7+,8+,9+,11+/m0/s1 | StdInChI = 1S/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = SQVRNKJHWKZAKO-YRMXFSIDSA-N | StdInChIKey = MVAWJSIDNICKHF-UHFFFAOYSA-N
}} }}
| Section2 = {{Chembox Properties | Section2 = {{Chembox Properties
| Formula = C<sub>12</sub>H<sub>14</sub>N<sub>2</sub>O<sub>2</sub>
|C=11|H=19|N=1|O=9
| MolarMass = 309.273 g/mol | MolarMass = 218.252 g/mol
| ExactMass = 309.105981 | Appearance =
| Density =
| Appearance = White crystalline powder
| Density = | MeltingPt =
| BoilingPt =
| MeltingPt = 186°C (decomposes)
| BoilingPt = | Solubility =
}} }}
| Section3 = {{Chembox Hazards | Section3 = {{Chembox Hazards
| Solubility = | MainHazards =
| MainHazards = | FlashPt =
| FlashPt = | Autoignition =
| Autoignition =
}} }}
}} }}

Revision as of 13:22, 24 November 2011

This page contains a copy of the infobox ({{chembox}}) taken from revid 453515484 of page N-Acetylserotonin with values updated to verified values.
N-Acetylserotonin
Names
IUPAC name N-acetamide
Other names N-acetyl-5-hydroxytryptamine, N-acetyl-5-HT
Identifiers
3D model (JSmol)
ChEBI
ChEMBL
ChemSpider
MeSH N-Acetylserotonin N-Acetylserotonin
PubChem CID
InChI
  • InChI=1S/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)Key: MVAWJSIDNICKHF-UHFFFAOYSA-N
  • InChI=1/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)Key: MVAWJSIDNICKHF-UHFFFAOYAX
SMILES
  • CC(=O)NCCC1=CNC2=C1C=C(C=C2)O
Properties
Chemical formula C12H14N2O2
Molar mass 218.252 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Chemical compound