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Revision as of 19:36, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 401784753 of page AMN082 for the Chem/Drugbox validation project (updated: 'CASNo').← Previous edit Revision as of 19:36, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 464466940 of page AMPA for the Chem/Drugbox validation project (updated: 'ChEMBL', '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
| Verifiedfields = changed
| verifiedrevid = 401783492 | verifiedrevid = 464364201
| ImageFile = AMN082_structure.png
| ImageSize = | ImageFile = AMPA.svg
| ImageSize = 200px
| IUPACName = N,N'-dibenzhydrylethane-1,2-diamine dihydrochloride
| IUPACName = 2-amino-3-(5-methyl-3-oxo-1,2-<br>oxazol-4-yl)propanoic acid
| OtherNames = | OtherNames =
| Section1 = {{Chembox Identifiers | Section1 = {{Chembox Identifiers
| InChIKey = UUDAMDVQRQNNHZ-UHFFFAOYAT
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| CASNo_Ref = {{cascite|changed|??}}
⚫ | ChemSpiderID = 9873115
⚫ | CASNo = <!-- blanked - oldvalue: 77521-29-0 -->
⚫ | PubChem = 1221
| ChEMBL_Ref = {{ebicite|changed|EBI}}
| ChEMBL = 13378
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| DrugBank = DB02057
| KEGG_Ref = {{keggcite|correct|kegg}}
| KEGG = C11033
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C28H28N2.2ClH/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)29-21-22-30-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;/h1-20,27-30H,21-22H2;2*1H | StdInChI = 1S/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = YRQCDCNQANSUPB-UHFFFAOYSA-N | StdInChIKey = UUDAMDVQRQNNHZ-UHFFFAOYSA-N
| SMILES = O=C1/C(=C(\ON1)C)CC(N)C(=O)O
| SMILES1 = Cl.Cl.N(CCNC(c1ccccc1)c2ccccc2)C(c3ccccc3)c4ccccc4
| InChI = 1/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)
⚫ | CASNo = <!-- blanked - oldvalue: 97075-46-2 -->
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | PubChem=11698390
⚫ | ChemSpiderID = 1184
| SMILES=C(NCCNC(c1ccccc1)c2ccccc2)(c3ccccc3)c4ccccc4.Cl.Cl
| MeSHName = AMPA
}} }}
| Section2 = {{Chembox Properties | Section2 = {{Chembox Properties
| C=7|H=10|N=2|O=4
| Formula=C<sub>28</sub>H<sub>30</sub>Cl<sub>2</sub>N<sub>2</sub>
| MolarMass=465.4572 | MolarMass = 186.17 g/mol
| Appearance= | Appearance =
| Density= | Density =
| MeltingPt= | MeltingPt =
| BoilingPt= | BoilingPt =
| Solubility=
}} }}
| Section3 = {{Chembox Hazards | Section3 = {{Chembox Hazards
| MainHazards= | Solubility =
| FlashPt= | MainHazards =
| Autoignition= | FlashPt =
| Autoignition =
}} }}
}} }}

Revision as of 19:36, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 464466940 of page AMPA with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC names 2-amino-3-(5-methyl-3-oxo-1,2-
oxazol-4-yl)propanoic acid
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
DrugBank
KEGG
MeSH AMPA
PubChem CID
InChI
  • InChI=1S/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)Key: UUDAMDVQRQNNHZ-UHFFFAOYSA-N
  • InChI=1/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)Key: UUDAMDVQRQNNHZ-UHFFFAOYAT
SMILES
  • O=C1/C(=C(\ON1)C)CC(N)C(=O)O
Properties
Chemical formula C7H10N2O4
Molar mass 186.17 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). ☒N verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound