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Revision as of 07:21, 18 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{drugbox}} taken from revid 476407199 of page Lacosamide for the Chem/Drugbox validation project (updated: 'CAS_number').← Previous edit		Revision as of 07:21, 18 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 474541488 of page Lactose for the Chem/Drugbox validation project (updated: 'ChEMBL').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
	\| Watchedfields = changed		\| Watchedfields = changed
	\| verifiedrevid = ~~408570708~~		\| verifiedrevid = 400128939
			\| Name = Lactose (Milk sugar)
	\| IUPAC_name = ''N''<sup>2</sup>-acetyl-''N''-benzyl-<small>D</small>-homoserinamide
	\| ~~image~~ = ~~Lacosamide~~.svg		\| ImageFile = Beta-D-Lactose.svg
			\| ImageSize = 300px

			\| IUPACName = β-<small>D</small>-galactopyranosyl-(1→4)-<small>D</small>-glucose
	<!--Clinical data-->
			\| OtherNames = Milk sugar<br/>4-''O''-β-<small>D</small>-galactopyranosyl-<small>D</small>-glucose
	\| tradename = Vimpat
			\| Section1 = {{Chembox Identifiers
	\| Drugs.com = {{drugs.com\|monograph\|lacosamide}}
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| MedlinePlus = a609028
		⚫	\| ChemSpiderID = 5904
	\| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
			\| InChI = 1/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1
	\| pregnancy_US = <!-- A / B / C / D / X -->
			\| InChIKey = GUBGYTABKSRVRQ-DCSYEGIMBP
	\| 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 = Schedule V (U.S.)
	\| routes_of_administration = Oral, ]

	<!--Pharmacokinetic data-->
	\| bioavailability = High
	\| protein_bound =
	\| metabolism =
	\| elimination_half-life = 13 hours
	\| excretion =

	<!--Identifiers-->
⚫	\| ~~CAS_number_Ref~~ = {{cascite\|correct\|??}}
⚫	\| ~~CAS_number~~ = <!-- blanked - oldvalue: ~~175481-36-4~~ -->
	\| ATC_prefix = N03
	\| ATC_suffix = AX18
⚫	\| PubChem = ~~219078~~
	\| DrugBank_Ref = {{drugbankcite\|correct\|drugbank}}
	\| DrugBank =
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
⚫	\| ChemSpiderID = ~~189902~~
⚫	\| UNII_Ref = {{fdacite\|changed\|FDA}}
⚫	\| UNII = ~~563KS2PQY5~~
	\| KEGG_Ref = {{keggcite\|correct\|kegg}}
	\| KEGG = D07299
⚫	\| ChEMBL_Ref = {{ebicite\|~~correct~~\|EBI}}
	\| ChEMBL = 58323

	<!--Chemical data-->
	\| C=13 \| H=18 \| N=2 \| O=3
	\| molecular_weight = 250.294 g/mol
	\| smiles = O=C(N(C(=O)NCc1ccccc1)COC)C
	\| InChI = 1/C13H18N2O3/c1-10(16)15-12(9-18-2)13(17)14-8-11-6-4-3-5-7-11/h3-7,12H,8-9H2,1-2H3,(H,14,17)(H,15,16)/t12-/m1/s1
	\| InChIKey = VPPJLAIAVCUEMN-GFCCVEGCBX
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C13H18N2O3~~/c1-10(16)~~15-~~12(9-18-2)13(17)~~14-~~8-11-6-4-3-5-7-~~11/h3-7,12H~~,8-~~9H2~~,1-~~2H3~~,(H,~~14,17)(H~~,~~15,16)/t12-~~/m1/s1		\| StdInChI = 1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~VPPJLAIAVCUEMN~~-~~GFCCVEGCSA~~-N		\| StdInChIKey = GUBGYTABKSRVRQ-DCSYEGIMSA-N
			\| CASNo = 63-42-3
	\| synonyms = <small>(2''R'')-2-(acetylamino)-''N''-benzyl-3-methoxypropanamide</small>
		⚫	\| CASNo_Ref = {{cascite\|correct\|CAS}}
			\| EC-number = 200-559-2
		⚫	\| PubChem = 6134
		⚫	\| ChEMBL_Ref = {{ebicite\|changed\|EBI}}
		⚫	\| ChEMBL = <!-- blanked - oldvalue: 1159651 -->
		⚫	\| UNII_Ref = {{fdacite\|changed\|FDA}}
		⚫	\| UNII = J2B2A4N98G
			\| ChEBI_Ref = {{ebicite\|changed\|EBI}}
			\| ChEBI = 36218
			\| SMILES = C(1((((O1)O2(O((2O)O)O)CO)O)O)O)O
			}}
			\| Section2 = {{Chembox Properties
			\| Formula = C<sub>12</sub>H<sub>22</sub>O<sub>11</sub>
			\| MolarMass = 342.30 g/mol
			\| Appearance = white solid
			\| Density = 1.525 g/cm<sup>3</sup>
			\| MeltingPt = 202.8 °C<ref name=Ald>Anonymous. Sigma Aldrich. Lactose Product. http://www.sigmaaldrich.com/catalog/ProductDetail.do?lang=en&N4=17814\|FLUKA&N5=SEARCH_CONCAT_PNO\|BRAND_KEY&F=SPEC St. Louis MO.</ref>
			\| BoilingPt = 668.9 °C<ref name=Ald/>
			\| Solubility = 21.6 g/100 mL<ref>The solubility of lactose in water is 18.9049 g at 25 °C, 25.1484 g at 40 °C and 37.2149 g at 60 °C per 100 g solution. Its solubility in ] is 0.0111 g at 40 °C and 0.0270 g at 60 °C per 100 g solution.{{citation \| year = 2001 \| last1 = Machado \| first1 = José J. B. \| first2 = João A. \| last2 = Coutinho \| first3 = Eugénia A. \| last3 = Macedo \| title = Solid–liquid equilibrium of α-lactose in ethanol/water \| url = http://path.web.ua.pt/file/FPE%20(2000)%20173%20121.pdf \| journal = Fluid Phase Equilibria \| volume = 173 \| issue = 1 \| pages = 121–34 \| doi = 10.1016/S0378-3812(00)00388-5}}.
			ds</ref>
			}}
			\| Section4 = {{Chembox Thermochemistry\| DeltaHc = 5652 kJ/mol, 1351 kcal/mol, 16.5 kJ/g, 3.94 kcal/g}}
			\| Section7 = {{Chembox Hazards
			\| EUIndex = not listed
			\| FlashPt = 357.8 °C<ref name="Ald"/>
			\| Autoignition =
			}}
	}}		}}

Revision as of 07:21, 18 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 474541488 of page Lactose with values updated to verified values.

Lactose (Milk sugar)
Names

IUPAC name β-D-galactopyranosyl-(1→4)-D-glucose
Other names Milk sugar 4-O-β-D-galactopyranosyl-D-glucose
Identifiers
CAS Number	63-42-3
3D model (JSmol)	Interactive image
ChEBI	CHEBI:36218
ChemSpider	5904
PubChem CID	6134
UNII	J2B2A4N98G
InChI InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1Key: GUBGYTABKSRVRQ-DCSYEGIMSA-N InChI=1/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1Key: GUBGYTABKSRVRQ-DCSYEGIMBP
SMILES C(1((((O1)O2(O((2O)O)O)CO)O)O)O)O
Properties
Chemical formula	C₁₂H₂₂O₁₁
Molar mass	342.30 g/mol
Appearance	white solid
Density	1.525 g/cm
Melting point	202.8 °C
Boiling point	668.9 °C
Solubility in water	21.6 g/100 mL
Thermochemistry
Std enthalpy of combustion (Δ_cH₂₉₈)	5652 kJ/mol, 1351 kcal/mol, 16.5 kJ/g, 3.94 kcal/g
Hazards
Flash point	357.8 °C
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):

SizeSet

Chemical compound

^ Anonymous. Sigma Aldrich. Lactose Product. http://www.sigmaaldrich.com/catalog/ProductDetail.do?lang=en&N4=17814%7CFLUKA&N5=SEARCH_CONCAT_PNO%7CBRAND_KEY&F=SPEC St. Louis MO.
The solubility of lactose in water is 18.9049 g at 25 °C, 25.1484 g at 40 °C and 37.2149 g at 60 °C per 100 g solution. Its solubility in ethanol is 0.0111 g at 40 °C and 0.0270 g at 60 °C per 100 g solution.Machado, José J. B.; Coutinho, João A.; Macedo, Eugénia A. (2001), "Solid–liquid equilibrium of α-lactose in ethanol/water" (PDF), Fluid Phase Equilibria, 173 (1): 121–34, doi:10.1016/S0378-3812(00)00388-5. ds