Misplaced Pages

:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox: Difference between revisions - Misplaced Pages

Article snapshot taken from Wikipedia with creative commons attribution-sharealike license. Give it a read and then ask your questions in the chat. We can research this topic together.
< Misplaced Pages:WikiProject Chemicals | Chembox validation Browse history interactively← Previous editNext edit →Content deleted Content addedVisualWikitext
Revision as of 12:36, 24 November 2011 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 456758129 of page Miglustat for the Chem/Drugbox validation project (updated: 'DrugBank').← Previous edit Revision as of 12:36, 24 November 2011 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 400314321 of page Migrastatin for the Chem/Drugbox validation project (updated: 'ChEMBL').Next edit →
Line 1: Line 1:
{{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
⚫ | verifiedrevid = 400312989
| Verifiedfields = changed
| Name = '''Migrastatin'''
⚫ | verifiedrevid = 400312895
| ImageFile = Migrastatin.svg
| IUPAC_name = (2''R'',3''R'',4''R'',5''S'')-1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triol
| ImageName = Migrastatin
| image = Miglustat.svg
| Section1 = {{Chembox Identifiers

| InChI = 1/C27H39NO7/c1-17-14-18(2)27(35-25(32)13-8-6-5-7-12-22(34-4)26(17)33)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14-/t17-,19-,22+,26+,27+/m1/s1
<!--Clinical data-->
| InChIKey = OGYMUMAKGYYNHV-IJMHZYIBBB
| tradename =
| Drugs.com = {{drugs.com|monograph|miglustat}}
| MedlinePlus = a604015
| licence_US = Miglustat
| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
| pregnancy_US = X
| 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 = Rx-only
| legal_status =
| routes_of_administration = Oral

<!--Pharmacokinetic data-->
| bioavailability = 97%
| protein_bound = Nil
| metabolism = Nil
| elimination_half-life = 6–7 hours
| excretion = ], unchanged

<!--Identifiers-->
| CAS_number_Ref = {{cascite|correct|??}}
| CAS_number = 72599-27-0
| ATC_prefix = A16
| ATC_suffix = AX06
| PubChem = 51634
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| DrugBank = DB00419
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | ChemSpiderID = 46764
| UNII_Ref = {{fdacite|changed|FDA}}
| UNII = ADN3S497AZ
| ChEBI_Ref = {{ebicite|changed|EBI}}
| ChEBI = 50381
| ChEMBL_Ref = {{ebicite|changed|EBI}}
⚫ | ChEMBL = 1029

<!--Chemical data-->
| C=10 | H=21 | N=1 | O=4
| molecular_weight = 219.28 g/mol
| smiles = OC1N(CCCC)C(O)(O)1O
| InChI = 1/C10H21NO4/c1-2-3-4-11-5-8(13)10(15)9(14)7(11)6-12/h7-10,12-15H,2-6H2,1H3/t7-,8+,9-,10-/m1/s1
| InChIKey = UQRORFVVSGFNRO-UTINFBMNBD
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C10H21NO4/c1-2-3-4-11-5-8(13)10(15)9(14)7(11)6-12/h7-10,12-15H,2-6H2,1H3/t7-,8+,9-,10-/m1/s1 | StdInChI = 1S/C27H39NO7/c1-17-14-18(2)27(35-25(32)13-8-6-5-7-12-22(34-4)26(17)33)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14-/t17-,19-,22+,26+,27+/m1/s1
| SMILES = C1/C=C(\(OC(=O)/C=C/CC/C=C/(1O)OC)(C)C(=O)CCCC2CC(=O)NC(=O)C2)/C
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = UQRORFVVSGFNRO-UTINFBMNSA-N | StdInChIKey = OGYMUMAKGYYNHV-IJMHZYIBSA-N
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| synonyms = 1,5-(butylimino)-1,5-dideoxy-D-glucitol
⚫ | ChEMBL = 474321
⚫ | ChemSpiderID=21106454
}}
| Section2 = {{Chembox Properties
| Formula = C<sub>27</sub>H<sub>39</sub>NO<sub>7</sub>
| MolarMass = 489.60 g/mol}}
}} }}

Revision as of 12:36, 24 November 2011

This page contains a copy of the infobox ({{chembox}}) taken from revid 400314321 of page Migrastatin with values updated to verified values.
Migrastatin
Migrastatin
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
InChI
  • InChI=1S/C27H39NO7/c1-17-14-18(2)27(35-25(32)13-8-6-5-7-12-22(34-4)26(17)33)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14-/t17-,19-,22+,26+,27+/m1/s1Key: OGYMUMAKGYYNHV-IJMHZYIBSA-N
  • InChI=1/C27H39NO7/c1-17-14-18(2)27(35-25(32)13-8-6-5-7-12-22(34-4)26(17)33)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14-/t17-,19-,22+,26+,27+/m1/s1Key: OGYMUMAKGYYNHV-IJMHZYIBBB
SMILES
  • C1/C=C(\(OC(=O)/C=C/CC/C=C/(1O)OC)(C)C(=O)CCCC2CC(=O)NC(=O)C2)/C
Properties
Chemical formula C27H39NO7
Molar mass 489.60 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