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

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Revision as of 14:14, 5 December 2011 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 453649135 of page Prephenic_acid for the Chem/Drugbox validation project (updated: 'CASNo').← Previous edit		Revision as of 14:14, 5 December 2011 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 444066147 of page Prephytoene_diphosphate 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\|chembox}}) 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.}}
	{{chembox		{{chembox
	\| verifiedrevid = ~~440835385~~		\| verifiedrevid = 444064303
	\|ImageFile=~~Prephenic~~ ~~acid~~.~~svg~~		\|ImageFile=Prephytoene diphosphate.png
	\|ImageSize=~~150px~~		\|ImageSize=250px
			\|IUPACName=-2-cyclopropyl]methyl phosphono hydrogen phosphate
	\|IUPACName=1-(2-Carboxy-2-oxoethyl)-4-hydroxycyclohexa-2,5-dienecarboxylic acid
			\|OtherNames=Prephytoene pyrophosphate
	\|OtherNames=Prephenate; ''cis''-1-Carboxy-4-hydroxy-α-oxo-2,5-cyclohexadiene-1-propanoic acid
	\|Section1= {{Chembox Identifiers		\|Section1={{Chembox Identifiers
	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}		\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| ChemSpiderID = ~~16735981~~		\| ChemSpiderID = 4517882
			\| InChI = 1/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/b33-21+,34-22+,35-25+,36-27+,37-29+
	\| InChI = 1/C10H10O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6,11H,5H2,(H,13,14)(H,15,16)/t6-,10+
	\| InChIKey = ~~FPWMCUPFBRFMLH~~-~~XGAOUMNUBN~~		\| InChIKey = RVCNKTPCHZNAAO-QKUGLALCBM
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
			\| StdInChI = 1S/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/b33-21+,34-22+,35-25+,36-27+,37-29+
	\| StdInChI = 1S/C10H10O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6,11H,5H2,(H,13,14)(H,15,16)/t6-,10+
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~FPWMCUPFBRFMLH~~-~~XGAOUMNUSA~~-N		\| StdInChIKey = RVCNKTPCHZNAAO-QKUGLALCSA-N
	\| CASNo = <!-- blanked - oldvalue: ~~126~~-49-8 -->		\| CASNo = <!-- blanked - oldvalue: 38005-61-7 -->
		⚫	\| PubChem = 5365949
	\| ~~CASNo_Ref~~ = {{~~cascite~~\|correct\|~~CAS~~}}		\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| CASNo_Comment = (unspecified)
			\| ChEBI = 14885
	\| CASNo1=87664-40-2
			\| SMILES = O=P(O)(O)OP(=O)(O)OCC1C(\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)C)C1(CC/C=C(/CC\C=C(/C)CC\C=C(/C)C)C)C
	\| CASNo1_Ref = {{cascite\|correct\|CAS}}
		⚫	}}
	\| CASNo1_Comment = (''cis'')
		⚫	\|Section2={{Chembox Properties
⚫	\| PubChem=~~1028~~
			\| Formula=C<sub>40</sub>H<sub>68</sub>O<sub>7</sub>P<sub>2</sub>
	\| SMILES = O=C(O)/1(CC(=O)C(O)=O)\C=C/(O)\C=C\1
			\| MolarMass=722.91 g/mol
	\| MeSHName=Prephenic+acid
⚫	}}
⚫	\|Section2= {{Chembox Properties
	\| C=10\|H=10\|O=6
	\| Appearance=		\| Appearance=
	\| Density=		\| Density=
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	\| Solubility=		\| Solubility=
	}}		}}
	\|Section3= {{Chembox Hazards		\|Section3={{Chembox Hazards
	\| MainHazards=		\| MainHazards=
	\| FlashPt=		\| FlashPt=

Revision as of 14:14, 5 December 2011

This page contains a copy of the infobox ({{chembox}}) taken from revid 444066147 of page Prephytoene_diphosphate with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names

IUPAC name -2-cyclopropyl]methyl phosphono hydrogen phosphate
Other names Prephytoene pyrophosphate
Identifiers
3D model (JSmol)	Interactive image
ChEBI	CHEBI:14885
ChemSpider	4517882
PubChem CID	5365949
InChI InChI=1S/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/b33-21+,34-22+,35-25+,36-27+,37-29+Key: RVCNKTPCHZNAAO-QKUGLALCSA-N InChI=1/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/b33-21+,34-22+,35-25+,36-27+,37-29+Key: RVCNKTPCHZNAAO-QKUGLALCBM
SMILES O=P(O)(O)OP(=O)(O)OCC1C(\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)C)C1(CC/C=C(/CC\C=C(/C)CC\C=C(/C)C)C)C
Properties
Chemical formula	C₄₀H₆₈O₇P₂
Molar mass	722.91 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

Tracking categories (test):

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Chemical compound