Misplaced Pages

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

Article snapshot taken from Wikipedia with creative commons attribution-sharealike license. Give it a read and then ask your questions in the chat. We can research this topic together.
< Misplaced Pages:WikiProject Chemicals | Chembox validation Browse history interactively← Previous editContent deleted Content addedVisualWikitext
Revision as of 13:22, 24 November 2011 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 453515484 of page N-Acetylserotonin for the Chem/Drugbox validation project (updated: 'ChEMBL', 'ChEBI', 'CASNo').← Previous edit Latest revision as of 14:25, 29 January 2022 edit undo119.246.116.98 (talk)No edit summary 
Line 1: Line 1:
{{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 = 453514473 | verifiedrevid = 477001424
| 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
| Name = ''N''-Acetylserotonin
| image = L-Ascorbic_acid.svg
| ImageFile = N-Acetylserotonin.png
| ImageSize = | width = 200px
| ImageFile2 = N-Acetylserotonin-3D-sticks.png | image2 = Ascorbic-acid-from-xtal-1997-3D-balls.png
| width2 = 200px
| IUPACName = ''N''-acetamide

| OtherNames = ''N''-acetyl-5-hydroxytryptamine, ''N''-acetyl-5-HT
<!--Clinical data-->
| Section1 = {{Chembox Identifiers
| Drugs.com = {{drugs.com|MTM|vitamin_c}}
| CASNo = <!-- blanked - oldvalue: 1210-83-9 -->
| licence_EU = <!-- EMEA requires brand name -->
⚫ | ChEMBL = 33103
| licence_US = <!-- FDA may use generic name -->
| ChEBI = 17697
| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
| PubChem = 903
| pregnancy_US = <!-- A / B / C / D / X -->
| SMILES = CC(=O)NCCC1=CNC2=C1C=C(C=C2)O
| pregnancy_category = A
| MeSHName = ''N''-Acetylserotonin
| legal_AU = <!-- Unscheduled / S2 / S3 / S4 / S5 / S6 / S7 / S8 / S9 -->
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| legal_CA = <!-- / Schedule I, II, III, IV, V, VI, VII, VIII -->
⚫ | ChemSpiderID = 879
| legal_UK = <!-- GSL / P / POM / CD / Class A, B, C -->
| InChI = 1/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)
| legal_US = <!-- OTC / Rx-only / Schedule I, II, III, IV, V -->
| InChIKey = MVAWJSIDNICKHF-UHFFFAOYAX
| legal_status = general public availability
⚫ | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| routes_of_administration = oral
| StdInChI = 1S/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)

⚫ | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
<!--Pharmacokinetic data-->
⚫ | StdInChIKey = MVAWJSIDNICKHF-UHFFFAOYSA-N
| bioavailability = rapid & complete
}}
| protein_bound = negligible
| Section2 = {{Chembox Properties
| elimination_half-life = varies according to plasma concentration <!-- can be 30 min to weeks, depending on body stores -->
| Formula = C<sub>12</sub>H<sub>14</sub>N<sub>2</sub>O<sub>2</sub>
| excretion = renal
| MolarMass = 218.252 g/mol

| Appearance =
<!--Identifiers-->
| Density =
| CASNo_Ref = {{cascite|correct|CAS}}
| MeltingPt =
| CAS_number_Ref = {{cascite|correct|??}}
| BoilingPt =
| Solubility = | CAS_number = 50-81-7
| ATC_prefix = A
}}
| ATC_suffix = 11G
| Section3 = {{Chembox Hazards
| ChEBI_Ref = {{ebicite|correct|EBI}}
| MainHazards =
| FlashPt = | ChEBI = 29073
| Autoignition = | PubChem = 5785
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
}}
| DrugBank = DB00126
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | ChemSpiderID = 10189562
| NIAID_ChemDB = 002072
| UNII_Ref = {{fdacite|correct|FDA}}
| UNII = PQ6CK8PD0R
| KEGG_Ref = {{keggcite|correct|kegg}}
| KEGG = D00018
| ChEMBL_Ref = {{ebicite|correct|EBI}}
⚫ | ChEMBL = 196

<!--Chemical data-->
| chemical_formula =
| C=6 | H=7 | O=6
| molecular_weight = 176.12 g/]
| smiles = C((1C(=C(C(=O)O1)O)O)O)O
| 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
⚫ | 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)