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Revision as of 19:30, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 446117849 of page ABCN for the Chem/Drugbox validation project (updated: 'CASNo').← Previous edit Latest revision as of 14:25, 29 January 2022 edit undo119.246.116.98 (talk)No edit summary 
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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|drugbox}}) taken from revid of page ] with values updated to verified values.}}
{{Chembox {{drugbox
| verifiedrevid = 477001424
| Watchedfields = changed
| IUPAC_name = 2-Oxo-<small>L</small>-threo-hexono-1,4-lactone-2,3-enediol<br />''or''<br />(''R'')-3,4-dihydroxy-5-((''S'')- 1,2-dihydroxyethyl)furan-2(5''H'')-one
| verifiedrevid = 415292881
| image = L-Ascorbic_acid.svg
| ImageFile1 = ABCN-2D-skeletal.png
| width = 200px
| ImageFile1_Ref = {{chemboximage|correct|??}}
| image2 = Ascorbic-acid-from-xtal-1997-3D-balls.png
| ImageSize1 =
| width2 = 200px
| ImageName1 = Stereo, skeletal formula of ABCN

| ImageFile2 = ABCN-3D-sticks.png
<!--Clinical data-->
| ImageFile2_Ref = {{chemboximage|correct|??}}
| Drugs.com = {{drugs.com|MTM|vitamin_c}}
| ImageSize2 =
| licence_EU = <!-- EMEA requires brand name -->
| ImageName2 = Stick model of ABCN
| licence_US = <!-- FDA may use generic name -->
| ImageFile3 = ABCN-3D-vdW.png
| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
| ImageFile3_Ref = {{chemboximage|correct|??}}
| pregnancy_US = <!-- A / B / C / D / X -->
| ImageSize3 =
| pregnancy_category = A
| ImageName3 = Spacefill model of ABCN
| legal_AU = <!-- Unscheduled / S2 / S3 / S4 / S5 / S6 / S7 / S8 / S9 -->
| IUPACName = 1,1'-diazene-1,2-diyldicyclohexanecarbonitrile{{Citation needed|date = June 2011}}
| legal_CA = <!-- / Schedule I, II, III, IV, V, VI, VII, VIII -->
| Section1 = {{Chembox Identifiers
| legal_UK = <!-- GSL / P / POM / CD / Class A, B, C -->
| Abbreviations = ABCN
| legal_US = <!-- OTC / Rx-only / Schedule I, II, III, IV, V -->
| CASNo = <!-- blanked - oldvalue: 2094-98-6 -->
| legal_status = general public availability
| PubChem = 74978
| routes_of_administration = oral
| PubChem_Ref = {{Pubchemcite|correct|pubchem}}

| ChemSpiderID = 21159585
<!--Pharmacokinetic data-->
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| bioavailability = rapid & complete
| ChemSpiderID2 = 21427655
| protein_bound = negligible
| ChemSpiderID2_Ref = {{chemspidercite|correct|chemspider}}
| elimination_half-life = varies according to plasma concentration <!-- can be 30 min to weeks, depending on body stores -->
| ChemSpiderID2_Comment = <small></small>
| ChemSpiderID1 = 67533 | excretion = renal

| ChemSpiderID1_Ref = {{chemspidercite|correct|chemspider}}
<!--Identifiers-->
| ChemSpiderID1_Comment = <small></small>
| CASNo_Ref = {{cascite|correct|CAS}}
| EINECS = 218-254-8
| CAS_number_Ref = {{cascite|correct|??}}
| UNNumber = 3226
| Beilstein = 960744 | CAS_number = 50-81-7
| ATC_prefix = A
| SMILES = N#CC1(CCCCC1)N=NC1(CCCCC1)C#N
| ATC_suffix = 11G
| StdInChI = 1S/C14H20N4/c15-11-13(7-3-1-4-8-13)17-18-14(12-16)9-5-2-6-10-14/h1-10H2
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | ChEBI_Ref = {{ebicite|correct|EBI}}
| ChEBI = 29073
| InChI = 1/C14H20N4/c15-11-13(7-3-1-4-8-13)17-18-14(12-16)9-5-2-6-10-14/h1-10H2
| PubChem = 5785
| StdInChIKey = KYIKRXIYLAGAKQ-UHFFFAOYSA-N
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| DrugBank = DB00126
| InChIKey = KYIKRXIYLAGAKQ-UHFFFAOYAM
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
}}
| ChemSpiderID = 10189562
| Section2 = {{Chembox Properties
| NIAID_ChemDB = 002072
| Formula = {{Chem|C|14|N|4|H|20}}
| UNII_Ref = {{fdacite|correct|FDA}}
| MolarMass = 244.3354 g mol<sup>−1</sup>
| UNII = PQ6CK8PD0R
| ExactMass = 244.168796660 g mol<sup>−1</sup>
| KEGG_Ref = {{keggcite|correct|kegg}}
| MeltingPtCL = 114
| MeltingPtCH = 118 | KEGG = D00018
| ChEMBL_Ref = {{ebicite|correct|EBI}}
}}
| ChEMBL = 196
| Section3 = {{Chembox Hazards

| GHSPictograms = {{GHS flame}} {{GHS exclamation mark}}
<!--Chemical data-->
| GHSSignalWord = Danger
| chemical_formula =
| HPhrases = {{H-phrases|242|315|319|335}}
| C=6 | H=7 | O=6
| PPhrases = {{P-phrases|261|305+351+338}}
| molecular_weight = 176.12 g/]
| EUClass = {{Hazchem F}} {{Hazchem Xi}}
| smiles = C((1C(=C(C(=O)O1)O)O)O)O
| RPhrases = {{R11}}, {{R36/37/38}}
| InChI = 1/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1
| SPhrases = {{S26}}
| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
}}
| StdInChI = 1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = CIWBSHSKHKDKBQ-JLAZNSOCSA-N
| synonyms = <small>L</small>-ascorbic acid
| density = 1.694
| melting_point = 190
| boiling_point = 553
}} }}

Latest revision as of 14:25, 29 January 2022

This page contains a copy of the infobox ({{drugbox}}) taken from revid 477243833 of page Vitamin_C with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Clinical data
Other namesL-ascorbic acid
AHFS/Drugs.comMultum Consumer Information
Pregnancy
category
  • A
Routes of
administration
oral
ATC code
Legal status
Legal status
  • general public availability
Pharmacokinetic data
Bioavailabilityrapid & complete
Protein bindingnegligible
Elimination half-lifevaries according to plasma concentration
Excretionrenal
Identifiers
IUPAC name
  • 2-Oxo-L-threo-hexono-1,4-lactone-2,3-enediol
    or
    (R)-3,4-dihydroxy-5-((S)- 1,2-dihydroxyethyl)furan-2(5H)-one
CAS Number
PubChem CID
DrugBank
ChemSpider
UNII
KEGG
ChEBI
ChEMBL
NIAID ChemDB
Chemical and physical data
FormulaC6H7O6
Molar mass176.12 g/mole g·mol
3D model (JSmol)
Density1.694 g/cm
Melting point190 °C (374 °F)
Boiling point553 °C (1,027 °F)
SMILES
  • C((1C(=C(C(=O)O1)O)O)O)O
InChI
  • InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1
  • Key:CIWBSHSKHKDKBQ-JLAZNSOCSA-N
  (verify)