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

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Revision as of 16:18, 9 January 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 470252080 of page Bismuth_subsalicylate for the Chem/Drugbox validation project (updated: 'KEGG').← Previous edit		Revision as of 16:18, 9 January 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 469541539 of page Malachite_green for the Chem/Drugbox validation project (updated: '').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
		⚫	\| verifiedrevid = 438218601
	\| Verifiedfields = changed
			\| ImageFile =Malachite green structure.svg
⚫	\| verifiedrevid = ~~443425288~~
			\| ImageSize =
	\| IUPAC_name = 2-hydroxy-2''H'',4''H''-benzo1,3-dioxa-2-bismacyclohexan-4-one
			\| ImageFile1 = Malachite green oxalate.jpg
	\| image = Bismuth subsalicylate.png
			\| IUPACName = 4--''N'',''N''-dimethylaniline
	\| drug_name = Bismuth Subsalicylate
			\| OtherNames = Aniline green; Basic green 4; Diamond green B; Victoria green B
	\| image2 = Bismuth Subsalicylate.png
			\| Section1 = {{Chembox Identifiers

		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	<!--Clinical data-->
		⚫	\| ChemSpiderID = 10820
	\| tradename = Pepto-bismol
	\| MedlinePlus = a607040
	\| 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 = Oral

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

	<!--Identifiers-->
⚫	\| CASNo_Ref = {{cascite\|correct\|CAS}}
⚫	\| ~~CAS_number_Ref~~ = {{~~cascite~~\|correct\|??}}
	\| CAS_number = 14882-18-9
	\| ATC_prefix = none
	\| ATC_suffix =
⚫	\| PubChem = ~~16682734~~
	\| DrugBank_Ref = {{drugbankcite\|correct\|drugbank}}
	\| DrugBank = DB01294
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
⚫	\| ChemSpiderID = ~~17215772~~
	\| UNII_Ref = {{fdacite\|correct\|FDA}}
⚫	\| UNII = ~~62TEY51RR1~~
	\| KEGG_Ref = {{keggcite\|changed\|kegg}}
	\| KEGG = <!-- blanked - oldvalue: D00728 -->
	\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| ChEBI = 261649
	\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}		\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
	\| ChEMBL = ~~1120~~		\| ChEMBL = 186357
		⚫	\| UNII_Ref = {{fdacite\|correct\|FDA}}

		⚫	\| UNII = 12058M7ORO
	<!--Chemical data-->
			\| InChI = 1/C23H25N2.ClH/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4;/h5-17H,1-4H3;1H/q+1;/p-1
	\| chemical_formula =
			\| InChIKey = FDZZZRQASAIRJF-REWHXWOFAA
	\| C=7 \| H=5 \| Bi=1 \| O=4
	\| molecular_weight = 362.093 g/mol
	\| smiles = O1OC(=O)c2ccccc2O1
	\| InChI = 1/C7H6O3.Bi.H2O/c8-6-4-2-1-3-5(6)7(9)10;;/h1-4,8H,(H,9,10);;1H2/q;+3;/p-3/rC7H5BiO4/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4,10H
	\| InChIKey = ZREIPSZUJIFJNP-PEVRGXKGAC
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C7H6O3~~.~~Bi.H2O~~/c8-6-4-2-1-3-5(6)7(9)~~10;~~;/h1-4,~~8H,(H,9,10)~~;~~;1H2~~/q;+3;/p-3		\| StdInChI = 1S/C23H25N2.ClH/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4;/h5-17H,1-4H3;1H/q+1;/p-1
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~ZREIPSZUJIFJNP~~-UHFFFAOYSA-K		\| StdInChIKey = FDZZZRQASAIRJF-UHFFFAOYSA-M
		⚫	\| CASNo_Ref = {{cascite\|correct\|CAS}}
			\| CASNo = 569-64-2
		⚫	\| PubChem = 11294
			\| SMILES = CN(C)c1ccc(cc1)C(=C2C=CC(=(C)C)C=C2)c3ccccc3.
			\| ATCvet = yes
			\| ATCCode_prefix = P53
			\| ATCCode_suffix = AX16
			}}
			\| Section2 = {{Chembox Properties
			\| Formula = C<sub>23</sub>H<sub>25</sub>ClN<sub>2</sub> (chloride)
			\| MolarMass = 364.911 g/mol (chloride)
			\| Appearance =
			\| Density =
			\| MeltingPt =
			\| BoilingPt =
			\| Solubility =
			}}
			\| Section3 = {{Chembox Hazards
			\| MainHazards =
			\| FlashPt =
			\| Autoignition =
			}}
	}}		}}

Revision as of 16:18, 9 January 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 469541539 of page Malachite_green with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names


IUPAC name 4--N,N-dimethylaniline
Other names Aniline green; Basic green 4; Diamond green B; Victoria green B
Identifiers
CAS Number	569-64-2
3D model (JSmol)	Interactive image
ChEMBL	ChEMBL186357
ChemSpider	10820
PubChem CID	11294
UNII	12058M7ORO
InChI InChI=1S/C23H25N2.ClH/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4;/h5-17H,1-4H3;1H/q+1;/p-1Key: FDZZZRQASAIRJF-UHFFFAOYSA-M InChI=1/C23H25N2.ClH/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4;/h5-17H,1-4H3;1H/q+1;/p-1Key: FDZZZRQASAIRJF-REWHXWOFAA
SMILES CN(C)c1ccc(cc1)C(=C2C=CC(=(C)C)C=C2)c3ccccc3.
Properties
Chemical formula	C₂₃H₂₅ClN₂ (chloride)
Molar mass	364.911 g/mol (chloride)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

Chemical compound