The detailed description of a substance, typically at a level beyond what is used for prescribing.

Identifier by which this substance is known.

A business level version identifier of the substance.

Status of substance within the catalogue e.g. active, retired.

A high level categorization, e.g. polymer or nucleic acid, or food, chemical, biological, or a lower level such as the general types of polymer (linear or branch chain) or type of impurity (process related or contaminant).

If the substance applies to human or veterinary use.

The quality standard, established benchmark, to which substance complies (e.g. USP/NF, Ph. Eur, JP, BP, Company Standard).

Textual description of the substance.

Supporting literature.

Textual comment about the substance's catalogue or registry record.

The entity that creates, makes, produces or fabricates the substance. This is a set of potential manufacturers but is not necessarily comprehensive.

An entity that is the source for the substance. It may be different from the manufacturer. Supplier is synonymous to a distributor.

Moiety, for structural modifications.

Role that the moiety is playing.

Identifier by which this moiety substance is known.

Textual name for this moiety substance.

Stereochemistry type.

Optical activity type.

Molecular formula for this moiety of this substance, typically using the Hill system.

Quantitative value for this moiety.

The measurement type of the quantitative value. In capturing the actual relative amounts of substances or molecular fragments it may be necessary to indicate whether the amount refers to, for example, a mole ratio or weight ratio.

General specifications for this substance.

The method used to elucidate the characterization of the drug substance. Example: HPLC.

Describes the nature of the chemical entity and explains, for instance, whether this is a base or a salt form.

The description or justification in support of the interpretation of the data file.

The data produced by the analytical instrument or a pictorial representation of that data. Examples: a JCAMP, JDX, or ADX file, or a chromatogram or spectrum analysis.

General specifications for this substance.

A code expressing the type of property.

A value for the property.

General information detailing this substance.

The average mass of a molecule of a compound compared to 1/12 the mass of carbon 12 and calculated as the sum of the atomic weights of the constituent atoms.

The method by which the molecular weight was determined.

Type of molecular weight such as exact, average (also known as. number average), weight average.

Used to capture quantitative values for a variety of elements. If only limits are given, the arithmetic mean would be the average. If only a single definite value for a given element is given, it would be captured in this field.

Structural information.

Stereochemistry type.

Optical activity type.

An expression which states the number and type of atoms present in a molecule of a substance.

Specified per moiety according to the Hill system, i.e. first C, then H, then alphabetical, each moiety separated by a dot.

The molecular weight or weight range (for proteins, polymers or nucleic acids).

The method used to elucidate the structure of the drug substance. Examples: X-ray, NMR, Peptide mapping, Ligand binding assay.

The source of information about the structure.

A depiction of the structure of the substance.

The kind of structural representation (e.g. full, partial).

The structural representation as a text string in a standard format.

The format of the representation e.g. InChI, SMILES, MOLFILE, CDX, SDF, PDB, mmCIF. The logical content type rather than the physical file format of a document.

An attached file with the structural representation e.g. a molecular structure graphic of the substance, a JCAMP or AnIML file.

Codes associated with the substance.

The specific code.

Status of the code assignment, for example 'provisional', 'approved'.

The date at which the code status was changed as part of the terminology maintenance.

Any comment can be provided in this field, if necessary.

Supporting literature.

Names applicable to this substance.

The actual name.

Name type, for example 'systematic', 'scientific, 'brand'.

The status of the name, for example 'current', 'proposed'.

If this is the preferred name for this substance.

Human language that the name is written in.

The use context of this name for example if there is a different name a drug active ingredient as opposed to a food colour additive.

The jurisdiction where this name applies.

A synonym of this particular name, by which the substance is also known.

A translation for this name into another human language.

Details of the official nature of this name.

Which authority uses this official name.

The status of the official name, for example 'draft', 'active', 'retired'.

Date of the official name change.

Supporting literature.

A link between this substance and another, with details of the relationship.

A pointer to another substance, as a resource or just a representational code.

For example "salt to parent", "active moiety", "starting material", "polymorph", "impurity of".

For example where an enzyme strongly bonds with a particular substance, this is a defining relationship for that enzyme, out of several possible substance relationships.

A numeric factor for the relationship, for instance to express that the salt of a substance has some percentage of the active substance in relation to some other.

For use when the numeric has an uncertain range.

An operator for the amount, for example "average", "approximately", "less than".

Supporting literature.

Data items specific to nucleic acids.

Data items specific to polymers.

Data items specific to proteins.

Material or taxonomic/anatomical source for the substance.

A classification that provides the origin of the raw material. Example: cat hair would be an Animal source type.

The genus of an organism, typically referring to the Latin epithet of the genus element of the plant/animal scientific name.

The species of an organism, typically referring to the Latin epithet of the species of the plant/animal.

An anatomical origin of the source material within an organism.

The country or countries where the material is harvested.