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Revision as of 18:27, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 452630594 of page 5-Androstenediol for the Chem/Drugbox validation project (updated: '').← Previous edit Revision as of 18:27, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 467652880 of page 5-Benzyloxytryptamine for the Chem/Drugbox validation project (updated: '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 = 451561330
| Watchedfields = changed
| IUPAC_name = 2-(5-phenylmethoxy-1''H''-indol-3-yl)ethanamine
⚫ | verifiedrevid = 443354154
⚫ | image = 5-benzyloxytryptamine.png
| IUPAC_name = (3''S'',8''R'',9''S'',10''R'',13''S'',14''S'',17''S'')-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1''H''-cyclopentaphenanthrene-3,17-diol
⚫ | image = 5-Androstenediol.png
| image2 = 5-Androstenediol3D.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 = <!-- 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 =
| metabolism =
| elimination_half-life =
| excretion =


<!--Identifiers--> <!--Identifiers-->
| CASNo_Ref = {{cascite|correct|CAS}} | CASNo_Ref = {{cascite|??|??}}
⚫ | CAS_number_Ref = {{cascite|correct|??}}
| CAS_number = 521-17-5
| CAS_number = <!-- blanked - oldvalue: 20776-45-8 -->
| ATC_prefix =
| ATC_suffix = | PubChem = 89576
| PubChem = 10634 | IUPHAR_ligand =
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| DrugBank =
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID = 10188 | ChemSpiderID = 80845
⚫ | UNII_Ref = {{fdacite|correct|FDA}}
| UNII = 95PS51EMXY
| ChEBI_Ref = {{ebicite|correct|EBI}}
| ChEBI = 2710
| ChEMBL_Ref = {{ebicite|correct|EBI}}
| ChEMBL = 440283


<!--Chemical data--> <!--Chemical data-->
| C=19 | H=30 | O=2 | C=17 | H=18 | N=2 | O=1
| molecular_weight = 290.44 | molecular_weight = 266.34 g/mol
| smiles = O4C/C3=C/C1(CC2((O)CC12)C)3(C)CC4 | smiles = NCCC1=CNC2=CC=C(OCC3=CC=CC=C3)C=C21
| InChI = 1/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-17,20-21H,4-11H2,1-2H3/t13-,14-,15-,16-,17-,18-,19-/m0/s1 | InChI = 1/C17H18N2O/c18-9-8-14-11-19-17-7-6-15(10-16(14)17)20-12-13-4-2-1-3-5-13/h1-7,10-11,19H,8-9,12,18H2
| InChIKey = QADHLRWLCPCEKT-LOVVWNRFBV | InChIKey =
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-17,20-21H,4-11H2,1-2H3/t13-,14-,15-,16-,17-,18-,19-/m0/s1 | StdInChI = 1S/C17H18N2O/c18-9-8-14-11-19-17-7-6-15(10-16(14)17)20-12-13-4-2-1-3-5-13/h1-7,10-11,19H,8-9,12,18H2
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = QADHLRWLCPCEKT-LOVVWNRFSA-N | StdInChIKey = WKPDXBXNJWWWGQ-UHFFFAOYSA-N
}} }}

Revision as of 18:27, 16 February 2012

This page contains a copy of the infobox ({{drugbox}}) taken from revid 467652880 of page 5-Benzyloxytryptamine with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Identifiers
IUPAC name
  • 2-(5-phenylmethoxy-1H-indol-3-yl)ethanamine
PubChem CID
ChemSpider
Chemical and physical data
FormulaC17H18N2O
Molar mass266.34 g/mol g·mol
3D model (JSmol)
SMILES
  • NCCC1=CNC2=CC=C(OCC3=CC=CC=C3)C=C21
InChI
  • InChI=1S/C17H18N2O/c18-9-8-14-11-19-17-7-6-15(10-16(14)17)20-12-13-4-2-1-3-5-13/h1-7,10-11,19H,8-9,12,18H2
  • Key:WKPDXBXNJWWWGQ-UHFFFAOYSA-N
  (verify)