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Revision as of 14:48, 17 November 2011 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 456696596 of page Gadoversetamide for the Chem/Drugbox validation project (updated: 'DrugBank', 'ChEMBL').← Previous edit Revision as of 14:49, 17 November 2011 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 456609432 of page Galactosamine 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|drugbox}}) 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.}}
{{Drugbox {{chembox
| Verifiedfields = changed | Verifiedfields = changed
| verifiedrevid = 396141528 | verifiedrevid = 400097576
| reference = <ref>''Merck Index'', 11th Edition, '''4240'''.</ref>
| IUPAC_name =
| image = Gadoversetamide.png | ImageFile = galactosamine.png
| ImageFile1 = alpha-D-galactosamine.png
| width = 250
| ImageSize = 150px
| image2 = Gadoversetamide3D.png
| ImageSize1 = 150px

| IUPACName = 2-Amino-2-deoxy-D-galactose
<!--Clinical data-->
| OtherNames = α-D-galactosamine
| tradename =
| Section1 = {{Chembox Identifiers
| Drugs.com = {{drugs.com|CONS|gadoversetamide}}
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
| pregnancy_US = C | ChemSpiderID = 22576
| pregnancy_category =
| legal_AU = <!-- Unscheduled / S2 / S3 / S4 / S5 / S6 / S7 / S8 / S9 -->
| legal_CA = <!-- / Schedule I, II, III, IV, V, VI, VII, VIII -->
| legal_UK = <!-- GSL / P / POM / CD / Class A, B, C -->
| legal_US = <!-- OTC / Rx-only / Schedule I, II, III, IV, V -->
| legal_status =
| routes_of_administration = ]

<!--Pharmacokinetic data-->
| bioavailability =
| protein_bound = Nil
| metabolism = Nil
| elimination_half-life = 80 to 120 minutes
| excretion = ]

<!--Identifiers-->
⚫ | CASNo_Ref = {{cascite|correct|CAS}}
| CAS_number_Ref = {{cascite|correct|??}}
| CAS_number = 131069-91-5
| ATC_prefix = V08
| ATC_suffix = CA06
⚫ | PubChem = 6435809
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| DrugBank = DB00538
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID = 392041
| UNII_Ref = {{fdacite|correct|FDA}}
| UNII = RLM74T3Z9D
⚫ | KEGG_Ref = {{keggcite|changed|kegg}}
| KEGG = D01646
| ChEMBL_Ref = {{ebicite|changed|EBI}} | ChEMBL_Ref = {{ebicite|changed|EBI}}
| ChEMBL = <!-- blanked - oldvalue: 1200457 --> | ChEMBL = <!-- blanked - oldvalue: 207280 -->
| InChI = 1/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1
| C=20 | H=34 | Gd=1 | N=5 | O=10
| InChIKey = MSWZFWKMSRAUBD-GASJEMHNBA
| molecular_weight = 661.77 g/mol
| smiles = .O=C(NCCOC)CN(CC()=O)CCN(CC()=O)CCN(CC(=O)NCCOC)CC()=O
| InChI = 1/C20H37N5O10.Gd/c1-34-9-3-21-16(26)11-24(14-19(30)31)7-5-23(13-18(28)29)6-8-25(15-20(32)33)12-17(27)22-4-10-35-2;/h3-15H2,1-2H3,(H,21,26)(H,22,27)(H,28,29)(H,30,31)(H,32,33);/q;+3/p-3
| InChIKey = HBEAOBRDTOXWRZ-DFZHHIFOAS
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C20H37N5O10.Gd/c1-34-9-3-21-16(26)11-24(14-19(30)31)7-5-23(13-18(28)29)6-8-25(15-20(32)33)12-17(27)22-4-10-35-2;/h3-15H2,1-2H3,(H,21,26)(H,22,27)(H,28,29)(H,30,31)(H,32,33);/q;+3/p-3 | StdInChI = 1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = HBEAOBRDTOXWRZ-UHFFFAOYSA-K | StdInChIKey = MSWZFWKMSRAUBD-GASJEMHNSA-N
⚫ | CASNo_Ref = {{cascite|correct|??}}
| CASNo = <!-- blanked - oldvalue: 7535-00-4 -->
⚫ | PubChem = 24154
⚫ | ChEBI_Ref = {{ebicite|changed|EBI}}
| ChEBI = 60312
| SMILES = O1(O)(OC(O)1N)CO
}}
| Section2 = {{Chembox Properties
| Formula = C<sub>6</sub>H<sub>13</sub>NO<sub>5</sub>
| MolarMass = 179.171 g/mol
| Appearance =
| Density =
| MeltingPt = 180 °C (HCl salt)
| BoilingPt =
| Solubility =
}}
| Section3 = {{Chembox Hazards
| MainHazards =
| FlashPt =
| Autoignition =
}}
}} }}

Revision as of 14:49, 17 November 2011

This page contains a copy of the infobox ({{chembox}}) taken from revid 456609432 of page Galactosamine with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name 2-Amino-2-deoxy-D-galactose
Other names α-D-galactosamine
Identifiers
3D model (JSmol)
ChEBI
ChemSpider
PubChem CID
InChI
  • InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1Key: MSWZFWKMSRAUBD-GASJEMHNSA-N
  • InChI=1/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1Key: MSWZFWKMSRAUBD-GASJEMHNBA
SMILES
  • O1(O)(OC(O)1N)CO
Properties
Chemical formula C6H13NO5
Molar mass 179.171 g/mol
Melting point 180 °C (HCl salt)
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
  1. Merck Index, 11th Edition, 4240.