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

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Revision as of 20:04, 16 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 456686920 of page Actarit for the Chem/Drugbox validation project (updated: 'CAS_number').← Previous edit		Revision as of 20:04, 16 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 468272392 of page Actinidine for the Chem/Drugbox validation project (updated: 'CASNo').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 = ~~451226756~~		\| verifiedrevid = 452830075
			\| Name = Actinidine
	\| IUPAC_name = 4-(Acetylamino)-benzeneacetic acid
			\| ImageFile = Actinidine chemical structure.png
	\| image = actarit.png
	\| ~~alt~~ =		<!-- \| ImageSize = 200px -->
			\| ImageName = Line Structure

			\| ImageFile1 = Actinidine Space-Filling.png
	<!--Clinical data-->
			<!-- \| ImageSize1 = 200px -->
	\| tradename =
			\| ImageName1 = Space-filling
	\| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
			\| IUPACName = (S)-4,7-Dimethyl-6,7-dihydro-<br />5H-cyclopentapyridine
	\| pregnancy_US = <!-- A / B / C / D / X -->
			\| Section1 = {{Chembox Identifiers
	\| pregnancy_category =
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| legal_AU = <!-- S2, S3, S4, S5, S6, S7, S8, S9 or Unscheduled-->
		⚫	\| ChemSpiderID = 61533
	\| 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 =
	\| routes_of_administration =

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

	<!--Identifiers-->
⚫	\| ~~CAS_number_Ref~~ = {{cascite\|correct\|??}}
⚫	\| ~~CAS_number~~ = <!-- blanked - oldvalue: ~~18699~~-02-0 -->
	\| ATCvet =
	\| ATC_prefix = none
	\| ATC_suffix =
	\| PubChem =
	\| DrugBank_Ref = {{drugbankcite\|correct\|drugbank}}
	\| DrugBank =
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
⚫	\| ChemSpiderID = ~~1941~~
⚫	\| ~~UNII_Ref~~ = {{~~fdacite~~\|correct\|~~FDA~~}}
	\| UNII = HW5B6351RZ
	\| KEGG_Ref = {{keggcite\|correct\|kegg}}		\| KEGG_Ref = {{keggcite\|correct\|kegg}}
	\| KEGG = ~~D01395~~		\| KEGG = C09910
			\| InChI = 1/C10H13N/c1-7-3-4-9-8(2)5-11-6-10(7)9/h5-7H,3-4H2,1-2H3/t7-/m0/s1

			\| InChIKey = ZHQQRIUYLMXDPP-ZETCQYMHBZ
	<!--Chemical data-->
			\| SMILES1 = n1cc(c2c(c1)(CC2)C)C
	\| chemical_formula =

	\| molecular_weight = 193.20 g/mol
	\| smiles = O=C(O)Cc1ccc(cc1)NC(=O)C
	\| InChI = 1/C10H11NO3/c1-7(12)11-9-4-2-8(3-5-9)6-10(13)14/h2-5H,6H2,1H3,(H,11,12)(H,13,14)
	\| InChIKey = MROJXXOCABQVEF-UHFFFAOYAC
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C10H11NO3~~/c1-7~~(12)11~~-9-4-2-8(3-5-9)6-10(13)14/h2-5H,~~6H2~~,~~1H3,(H,11,12)(H,13,14)~~		\| StdInChI = 1S/C10H13N/c1-7-3-4-9-8(2)5-11-6-10(7)9/h5-7H,3-4H2,1-2H3/t7-/m0/s1
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~MROJXXOCABQVEF~~-~~UHFFFAOYSA~~-N		\| StdInChIKey = ZHQQRIUYLMXDPP-ZETCQYMHSA-N
		⚫	\| CASNo_Ref = {{cascite\|correct\|??}}
		⚫	\| CASNo = <!-- blanked - oldvalue: 524-03-8 -->
		⚫	\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
			\| ChEBI = 2443
			\| SMILES = C(CC1)C2=C1C(C)=CN=C2
			}}
			\| Section2 = {{Chembox Properties
			\| Formula = C<sub>10</sub>H<sub>13</sub>N
			\| MolarMass = 147.219 g/mol
			\| Density =
			\| MeltingPt =<25 °C
			\| BoilingPt = 100-103 °C at 9 mmHg<ref>Sakan, Takeo; ''Bulletin of the Chemical Society of Japan'', 1959, V32, P315-16.</ref>
			}}
	}}		}}

Revision as of 20:04, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 468272392 of page Actinidine with values updated to verified values.

Actinidine
Names


IUPAC names (S)-4,7-Dimethyl-6,7-dihydro- 5H-cyclopentapyridine
Identifiers
3D model (JSmol)	Interactive image Interactive image
ChEBI	CHEBI:2443
ChemSpider	61533
KEGG	C09910
InChI InChI=1S/C10H13N/c1-7-3-4-9-8(2)5-11-6-10(7)9/h5-7H,3-4H2,1-2H3/t7-/m0/s1Key: ZHQQRIUYLMXDPP-ZETCQYMHSA-N InChI=1/C10H13N/c1-7-3-4-9-8(2)5-11-6-10(7)9/h5-7H,3-4H2,1-2H3/t7-/m0/s1Key: ZHQQRIUYLMXDPP-ZETCQYMHBZ
SMILES C(CC1)C2=C1C(C)=CN=C2 n1cc(c2c(c1)(CC2)C)C
Properties
Chemical formula	C₁₀H₁₃N
Molar mass	147.219 g/mol
Melting point	<25 °C
Boiling point	100-103 °C at 9 mmHg
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

Sakan, Takeo; Bulletin of the Chemical Society of Japan, 1959, V32, P315-16.