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Revision as of 14:29, 17 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,081 edits Saving copy of the {{drugbox}} taken from revid 477353269 of page Balofloxacin for the Chem/Drugbox validation project (updated: 'CAS_number').← Previous edit Revision as of 14:29, 17 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,081 edits Saving copy of the {{drugbox}} taken from revid 473857949 of page Barakol for the Chem/Drugbox validation project (updated: 'StdInChI', 'StdInChIKey', 'CAS_number').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|drugbox}}) taken from revid of page ] with values updated to verified values.}}
{{Drugbox {{Drugbox
⚫ | verifiedrevid = 451223287
| Verifiedfields = changed
| IUPAC_name = 2,5-Dimethyl-3aH-pyrano-1-benzopyran-3a,8-diol
⚫ | verifiedrevid = 461211442
⚫ | image = Barakol_structure.png
| IUPAC_name = 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylaminopiperidin-1-yl)-4-oxoquinoline-3-carboxylic acid
| width = 220
⚫ | image = Balofloxacin.png


<!--Clinical data--> <!--Clinical data-->
| tradename = | tradename =
| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
| pregnancy_US = <!-- A / B / C / D / X -->
| pregnancy_category =
| legal_AU = <!-- S2, S3, S4, S5, S6, S7, S8, S9 or Unscheduled-->
| legal_CA = <!-- Schedule I, II, III, IV, V, VI, VII, VIII -->
| legal_UK = <!-- GSL, P, POM, CD, or Class A, B, C -->
| legal_US = <!-- OTC / Rx-only / Schedule I, II, III, IV, V -->
| legal_status = | legal_status =
| routes_of_administration =

<!--Pharmacokinetic data-->
| bioavailability =
| protein_bound =
| metabolism =
| elimination_half-life =
| excretion =


<!--Identifiers--> <!--Identifiers-->
| CAS_number_Ref = {{cascite|correct|??}} | CAS_number_Ref = {{cascite|correct|??}}
| CAS_number = <!-- blanked - oldvalue: 127294-70-6 --> | CAS_number = <!-- blanked - oldvalue: 24506-68-1 -->
| ATC_prefix = none | ATC_prefix = none
| StdInChI = 1S/C13H12O4/c1-7-3-9-4-10(14)5-11-12(9)13(15,17-7)6-8(2)16-11/h3-6,14-15H,1-2H3
| ATC_suffix =
⚫ | StdInChIKey = LVPNMZHEDIKUFK-UHFFFAOYSA-N
| ATC_supplemental =
⚫ | PubChem = 3080731
| ChEMBL_Ref = {{ebicite|changed|EBI}}
| ChEMBL = 1210954
⚫ | PubChem = 65958
| DrugBank_Ref = {{drugbankcite|correct|drugbank}} | DrugBank_Ref = {{drugbankcite|correct|drugbank}}
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| DrugBank =
⚫ | ChemSpiderID = 2338470
| UNII_Ref = {{fdacite|correct|FDA}}
| UNII = Q022B63JPM
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | ChemSpiderID = 59361
| InChI = 1/C20H24FN3O4/c1-22-11-4-3-7-23(9-11)17-15(21)8-13-16(19(17)28-2)24(12-5-6-12)10-14(18(13)25)20(26)27/h8,10-12,22H,3-7,9H2,1-2H3,(H,26,27)
| InChIKey = MGQLHRYJBWGORO-UHFFFAOYAR
| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C20H24FN3O4/c1-22-11-4-3-7-23(9-11)17-15(21)8-13-16(19(17)28-2)24(12-5-6-12)10-14(18(13)25)20(26)27/h8,10-12,22H,3-7,9H2,1-2H3,(H,26,27)
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
⚫ | StdInChIKey = MGQLHRYJBWGORO-UHFFFAOYSA-N


<!--Chemical data--> <!--Chemical data-->
⚫ | C=13 | H=12 | O=4
| chemical_formula =
⚫ | molecular_weight = 232.231 g/mol
⚫ | C=20 | H=24 | F=1 | N=3 | O=4
| smiles = CC2=Cc3cc(O)cc(c13)OC(C)=CC1(O)O2
⚫ | molecular_weight = 389.42 g/mol
| smiles = CNC1CCCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F
}} }}

Revision as of 14:29, 17 February 2012

This page contains a copy of the infobox ({{drugbox}}) taken from revid 473857949 of page Barakol with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Clinical data
ATC code
  • none
Identifiers
IUPAC name
  • 2,5-Dimethyl-3aH-pyrano-1-benzopyran-3a,8-diol
PubChem CID
ChemSpider
Chemical and physical data
FormulaC13H12O4
Molar mass232.231 g/mol g·mol
3D model (JSmol)
SMILES
  • CC2=Cc3cc(O)cc(c13)OC(C)=CC1(O)O2
InChI
  • InChI=1S/C13H12O4/c1-7-3-9-4-10(14)5-11-12(9)13(15,17-7)6-8(2)16-11/h3-6,14-15H,1-2H3
  • Key:LVPNMZHEDIKUFK-UHFFFAOYSA-N
  (verify)
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