Slot: smiles

The slot to provide the canonical SMILES descriptor of a ChemicalEntity.

URI: SIO:000008

Inheritance

• has_qualitative_attribute
  • smiles

Applicable Classes

Name	Description	Modifies Slot
ChemicalEntity	Any constitutionally or isotopically distinct atom, molecule, ion, ion pair, radical, radical ion, complex, conformer etc., identifiable as a separately distinguishable entity.	no

Properties

Type and Range

Property	Value
Range	SMILES
Domain Of	ChemicalEntity
Slot URI	SIO:000008

Cardinality and Requirements

Property	Value
Recommended	Yes
Multivalued	Yes

Identifier and Mapping Information

Schema Source

• from schema: https://w3id.org/nfdi-de/dcat-ap-plus/chemistry/

Mappings

Mapping Type	Mapped Value
self	SIO:000008
native	chemdcatap:smiles

LinkML Source

name: smiles
description: The slot to provide the canonical SMILES descriptor of a ChemicalEntity.
from_schema: https://w3id.org/nfdi-de/dcat-ap-plus/chemistry/
rank: 1000
is_a: has_qualitative_attribute
slot_uri: SIO:000008
domain_of:
- ChemicalEntity
range: SMILES
recommended: true
multivalued: true
inlined: true
inlined_as_list: true