Chemical Substance Type

From OpenSemanticWorld
Category:OSW2afce49fe800460a95cf480cc0656757
Chemical Substance Type ID: OSW2afce49fe800460a95cf480cc0656757 | UUID: 2afce49f-e800-460a-95cf-480cc0656757
ID OSW2afce49fe800460a95cf480cc0656757
UUID 2afce49f-e800-460a-95cf-480cc0656757
Label Chemical Substance Type
Machine compatible name ChemicalSubstanceType
Types/Categories Category (Class)
Statements (outgoing)
Statements (incoming)
Details

Description[edit source]

Helps to create subcategories of Chemical Substance

jsondata
subclass_of
"Category:OSW182916df3eee472e88e7c8d114a7fe27"
type
"Category:Category"
uuid"2afce49f-e800-460a-95cf-480cc0656757"
label
text"Chemical Substance Type"
lang"en"
description
text"Helps to create subcategories of Chemical Substance"
lang"en"
name"ChemicalSubstanceType"
jsonschema
@context
cas_numbers
@id"Property:HasCasNumber"
@type"xsd:string"
inchi_id
@id"Property:HasInchiId"
@type"xsd:string"
inchi_key
@id"Property:HasInchiKey"
@type"xsd:string"
iupac_name
@id"Property:HasIupacName"
@type"xsd:string"
molecular_weight
@id"Property:HasMolecularWeight"
@type"xsd:float"
pubchem_cid
@id"Property:HasPubchemCid"
@type"xsd:string"
pubchem_sid
@id"Property:HasPubchemSid"
@type"xsd:string"
smiles_notation
@id"Property:HasSmilesNotation"
@type"xsd:string"
sum_formula
@id"Property:HasSumFormula"
@type"xsd:string"
"/wiki/Category:OSW182916df3eee472e88e7c8d114a7fe27?action=raw&slot=jsonschema"
allOf
$ref"/wiki/Category:OSW182916df3eee472e88e7c8d114a7fe27?action=raw&slot=jsonschema"
type"object"
uuid"2afce49f-e800-460a-95cf-480cc0656757"
title"ChemicalSubstanceType"
title*
en"Chemical Substance Type"
de"Typ von Chemische Substanz"
description"Helps to create subcategories of Chemical Substance."
description*
de"Hilft dabei Subkategorien von chemischer Verbindung zu erzeugen."
data_source_maps
id"pubchem.ncbi.nlm.nih.gov"
source"https://pubchem.ncbi.nlm.nih.gov/rest/pug_view/data/compound/{{pubchem_cid}}/JSON"
label"PubChem"
required
"pubchem_cid"
object_map
cas_numbers"$..[?(@.TOCHeading=='CAS')].Information..Value.StringWithMarkup..String"
required
"type"
defaultProperties
"cas_numbers"
"pubchem_cid"
"iupac_name"
"sum_formula"
"molecular_weight"
properties
type
default
"Category:OSW2afce49fe800460a95cf480cc0656757"
pubchem_cid
title"PubChem CID"
title*
de"PubChem CID"
description"The PubChem Compound Identifier (CID) is a unique identifier assigned by the PubChem database to a specific chemical compound or substance."
description*
de"Die PubChem Compound Identifier (CID) ist eine eindeutige Identifikationsnummer, die von der PubChem-Datenbank für eine spezifische chemische Verbindung oder Substanz vergeben wird."
type"string"
eval_template
type"mustache-wikitext"
mode"render"
value"[https://pubchem.ncbi.nlm.nih.gov/compound/{{pubchem_cid}} {{pubchem_cid}}]"
cas_numbers
type"array"
format"table"
title"CAS Number"
title*
de"CAS-Nummer"
description"The Chemical Abstracts Service (CAS) registry number is a unique identifier assigned by the Chemical Abstracts Service to a specific chemical compound or substance."
description*
de"Die CAS-Nummer (Chemical Abstracts Service) ist eine eindeutige Identifikationsnummer, die von der Chemical Abstracts Service für eine spezifische chemische Verbindung oder Substanz vergeben wird."
items
type"string"
title"CAS"
title*
de"CAS"
iupac_name
type"string"
title"Preferred IUPAC name"
title*
de"Bevorzugter IUPAC-Name"
description"The International Union of Pure and Applied Chemistry (IUPAC) name is the systematic name for a chemical substance, as defined by the IUPAC nomenclature rules."
description*
de"Der IUPAC-Name (International Union of Pure and Applied Chemistry) ist der systematische Name einer chemischen Substanz, wie er durch die IUPAC-Nomenklatur-Regeln definiert ist."
pubchem_sid
type"string"
title"PubChem SID"
title*
de"PubChem SID"
description"The PubChem Substance Identifier (SID) is a unique identifier assigned by the PubChem database to a specific chemical substance."
description*
de"Die PubChem Substance Identifier (SID) ist eine eindeutige Identifikationsnummer, die von der PubChem-Datenbank für eine spezifische chemische Substanz vergeben wird."
eval_template
type"mustache-wikitext"
mode"render"
value"[https://pubchem.ncbi.nlm.nih.gov/substance/{{pubchem_sid}} {{pubchem_sid}}]"
inchi
type"array"
format"table"
title"InChI"
description"The International Chemical Identifier (InChI) is a textual identifier for chemical substances, designed to provide a standard way to encode molecular information. The condensed, 27 character InChIKey is a hashed version of the full InChI"
description*
de"Der International Chemical Identifier (InChI) ist ein Textbezeichner für chemische Stoffe, der eine Standardmethode zur Codierung molekularer Informationen bieten soll. Der verkürzte, 27 Zeichen umfassende InChIKey ist eine gehashte Version des vollständigen InChI"
eval_template
type"mustache-wikitext"
mode"render"
value"<ul>{{#inchi}}<li>InChI={{inchi_id}}, Key: {{inchi_key}}{{/inchi}}</ul>"
items
type"object"
id"inchi_item"
required
"uuid"
"inchi_id"
defaultProperties
"inchi_id"
"inchi_key"
properties
uuid
type"string"
format"uuid"
options
hiddentrue
inchi_id
title"InChI"
type"string"
inchi_key
title"InChI key"
type"string"
smiles_notation
type"array"
format"table"
title"SMILES notation"
title*
de"SMILES-Notation"
description"Notation according to the SMILES formal language for describing chemical structures. SMILES stands for Simplified Molecular Input Line Entry System."
description*
de"Notation nach der SMILES-Formalsprache zur Beschreibung chemischer Strukturen. SMILES steht für Simplified Molecular Input Line Entry System."
items
type"string"
sum_formula
title"Summation formula"
title*
de"Summenformel"
description"The sum formula is a notation that specifies the number of atoms of each element in a molecule."
description*
de"Die Summenformel ist eine Notation, die die Anzahl der Atome jedes Elements in einem Molekül angibt."
type"string"
molecular_weight
title"Molecular weight / g/mol"
title*
de"Molekulargewicht / g/mol"
description"The molecular weight is the mass of a molecule, measured in atomic mass units (amu)."
description*
de"Das Molekulargewicht ist die Masse eines Moleküls, gemessen in Atommasseeinheiten (u)."
type"number"

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