loganin
Enable an agent to recognize loganin, assess the identity and condition of a supplied sample, and determine its suitability for a specified analytical or research use.
Bundle → Layer → Finding → Questions Filled
6 bundles · 11 layers · 16 findings · 26 questions
Loganin identity Establish the exact molecular entity represented by the registry entry.
Structure and stereochemistry
Represent the molecular features required for recognition.
Stereochemical identity test
Require a structure-level match that includes the glycoside, ester and stereochemical specification.
- Which authoritative stereochemical structure defines loganin for vr.tr.loganin? definition
- What evidence distinguishes the sample from an epimer, an aglycone or a related iridoid? measurement
Identifiers and neighbours
Resolve names and database records without merging distinct structures.
Identifier reconciliation
Keep identifier equivalence provisional when linked structures have not been compared.
- Do PubChem CIDs 87691 and 91727262 encode identical stereochemistry, different specificity or distinct entities? boundary
- Which read source supports each accepted CAS, EC, synonym and structure mapping? provenance
Loganin content and authentication Determine what a supplied sample contains and how confidently it is identified.
Analytical identification
Connect identification claims to methods and appropriate reference materials.
Orthogonal identity evidence
Assess chromatographic and spectroscopic agreement while recording unresolved isomer discrimination.
- Which reference-standard, MS and NMR comparisons support the loganin assignment? measurement
- Can the chosen method distinguish loganin from relevant co-eluting compounds and stereoisomers? boundary
Content and impurities
Quantify loganin separately from water, solvents and other constituents.
Usable loganin quantity
Base quantity and suitability decisions on validated content measurements and impurity limits.
- Is the reported purity a mass assay, chromatographic area percentage or another measurement, and on what basis? measurement
- Which residual solvents, related compounds or unidentified peaks could invalidate the intended use? action
Loganin form and stability Track the conditions under which a loganin sample remains usable.
Solid and solution properties
Record measured material properties with conditions and uncertainty.
Condition-specific properties
Distinguish documented dissolution and thermal behavior from assumed constants.
- What loganin solubility or dissolved concentration was measured in the intended solvent at the intended temperature? measurement
- Does thermal analysis establish melting, solvent loss or decomposition for this material form? measurement
Storage and transformation
Assess loss of loganin identity or content during storage and use.
Validated use window
Set storage and solution-use limits from measured stability, including investigation of possible glycoside or ester cleavage.
- Under the proposed pH, temperature and light conditions, what change in loganin content and impurity profile occurs over time? measurement
- What evidence sets the retest date, stock-solution use window and criteria for disposal? action
Loganin origin and biological context Connect loganin samples to their origin and carefully bounded biological evidence.
Material provenance
Trace isolated or synthesized loganin to verifiable records.
Source-to-sample trace
Separate literature occurrence records from the documented origin of the current lot.
- Was this lot isolated, synthesized or obtained through another route, and which records establish that route? provenance
- If botanical origin is claimed, which species, tissue and authenticated specimen support it? provenance
Biological role evidence
Attach pathway and activity claims to the experiments that support them.
Bounded biological attribution
Record the tested material, biological system and endpoint before attributing an effect or pathway role to loganin.
- Did the experiment test characterized loganin, a mixture or an extract, and at what measured concentration? boundary
- Which primary experiment supports the asserted biological effect or conversion involving loganin in the stated organism? provenance
Loganin handling and use Determine supported handling and use decisions for the specific material.
Hazard evidence
Track documented hazards and explicit information gaps for solid loganin and its solutions.
Material-specific handling basis
Tie handling decisions to applicable documentation, including solvent hazards for prepared solutions.
- Which current SDS and supporting evidence apply to this loganin lot and physical form? provenance
- Are GHS classifications and exposure limits documented, explicitly unestablished or simply absent from the available records? definition
Fitness for intended use
Evaluate whether the sample and evidence meet the requirements of a concrete proposed use.
Use eligibility decision
Require suitable identity, content, stability and applicable regulatory evidence before accepting a lot for use.
- What identity, assay uncertainty and impurity criteria must this loganin lot meet for the proposed analytical or research task? action
- Which jurisdiction-specific records establish whether the proposed use is permitted, restricted or unresolved? provenance
Evidence and external alignment What the world already says about this thing, gathered so the model can be checked against it.
Reported evidence
Findings from the breadth pass, kept separate from the structural claims.
Check these first
Recalled without web access and unsourced; every item is a lead to verify.
- Which of these check these first hold for the sense of loganin this model covers, and on what evidence? provenance
Identifiers and schemes
Recalled without web access and unsourced; every item is a lead to verify.
- Which of these identifiers and schemes hold for the sense of loganin this model covers, and on what evidence? provenance
Real-world use
Recalled without web access and unsourced; every item is a lead to verify.
- Which of these real-world use hold for the sense of loganin this model covers, and on what evidence? provenance
Typical measurements
Recalled without web access and unsourced; every item is a lead to verify.
- Which of these typical measurements hold for the sense of loganin this model covers, and on what evidence? provenance
Failure modes and hazards
Recalled without web access and unsourced; every item is a lead to verify.
- Which of these failure modes and hazards hold for the sense of loganin this model covers, and on what evidence? provenance
Neighbouring kinds and how to tell them apart
Recalled without web access and unsourced; every item is a lead to verify.
- Which of these neighbouring kinds and how to tell them apart hold for the sense of loganin this model covers, and on what evidence? provenance
Classifiers Filled
- Family
- Thing Registry
- Category
- Physical world and living systems
- Entry kind
- thing
- Plane
- PHY
- Domain
- PHY.MAT
What it is Filled
Loganin is a naturally occurring iridoid glucoside, structurally the methyl ester of loganic acid, that serves as an intermediate in plant biosynthesis of secologanin and downstream monoterpenoid indole alkaloids.
In scope
- Molecular identity, stereochemistry, synonyms and reconciled chemical identifiers
- Sample composition, grade, purity, impurities and analytical identity evidence
- Solid and solution states, measured properties and condition-dependent stability
- Isolation or synthesis provenance and links to biological occurrence
- Evidence supporting handling, research suitability and substance-specific restrictions
Out of scope
- Whole plants, botanical taxonomy and cultivation practices
- Complete compositions and claimed benefits of loganin-containing extracts or products
- Manufacturing and extraction processes as independently operated systems
- Separate substance models for loganic acid, loganetin, secologanin and loganin derivatives
- Disease models, treatment protocols and clinical prescribing decisions
Why it exists Filled
Enable an agent to recognize loganin, assess the identity and condition of a supplied sample, and determine its suitability for a specified analytical or research use.
Distinguishing features Filled
- Require agreement with the stereochemically specified loganin structure; a name or molecular formula alone cannot exclude stereoisomers. ChEBI identifies C17H26O10 and InChIKey AMBQHHVBBHTQBF-UOUCRYGSSA-N. [ChEBI](https://www.ebi.ac.uk/chebi/CHEBI:15771)
- Confirm the β-D-glucoside linkage and retained sugar to distinguish loganin from its functional parent loganetin. [ChEBI](https://www.ebi.ac.uk/chebi/CHEBI:15771)
- Confirm the methyl ester and hydroxyl substitution pattern when assessing possible confusion with loganic acid or 7-deoxyloganin. [ChEBI](https://www.ebi.ac.uk/chebi/CHEBI:15771)
- Require sample-specific separation and identity evidence before treating a plant extract or a peak labelled loganin as isolated loganin.
- Reconcile identifier records through structures: PubChem search identifies (-)-loganin as CID 87691, whereas ChEBI links CID 91727262; their equivalence remains unresolved here. [PubChem](https://pubchem.ncbi.nlm.nih.gov/compound/Loganin) [ChEBI](https://www.ebi.ac.uk/chebi/CHEBI:15771)
What robots and AI may and may not do Filled
Must not
- Present plant extracts containing loganin as proven medicines.
- Mislabel a sample or report its purity without analysis.
- Encourage wild collection of source plants beyond sustainable or permitted limits.
Only with a human decision
- Supplying it for tests on people or animals.
May
- Describe loganin and its place in plant iridoid biosynthesis from reliable sources.
- Track samples of it in an authorized laboratory inventory with label and source.
Moral aspects Filled
- Herbal products are often sold with health claims that outrun the evidence.
- Medicinal plants are part of traditional knowledge held by specific communities.
Who is affected
- Consumers of herbal products
- Researchers
- Traditional knowledge holders
Owners Filled
Steward
Nobody owns the compound; the laboratory or supplier answers for each sample.
Links to other meta-models Filled
parent
- Q103816238 - registry parent class
What else AI and robots need to interact with it Filled
Identity and identifiers required Filled
- Vercy registry: vr.tr.loganin
- Wikidata: Q15426222 (https://www.wikidata.org/wiki/Q15426222)
Direct properties required Filled
- Chemical identity: Stereochemical structure; formula C17H26O10; CAS 18524-94-2; CHEBI:15771
- Stereochemical confirmation: Confirmed against reference; partially supported; untested; inconsistent
- Loganin content: Mass fraction in % or mg/g, with method, uncertainty and as-received or dry basis
- Related-compound and residual impurity profile: Identified and unidentified components in % or mg/kg; detection and quantification limits
- Material form: Solid or solution; characterized solid form if known; solvent composition and water content
- Solution concentration and dissolved fraction: mg/mL or mmol/L; dissolved fraction in %; solvent, temperature and preparation time
- Thermal behavior: Transition or decomposition temperature in °C with method, pressure and heating rate
- Stability under specified conditions: Loganin remaining in % over hours or days, with temperature, light, pH and container conditions
- Source and lot provenance: Supplier and lot; isolation or synthesis record; organism and tissue when evidenced; certificate and reference standard
- Handling and regulatory evidence: Documented classification or unresolved status, with jurisdiction, date, supplier SDS and intended use
Recognition required Filled
- Usually supplied as a white to off-white solid in a labelled vial.
- Identity is confirmed by analysis, not by appearance.
Capabilities and actions required Filled
- Accept, quarantine or reject a labelled loganin sample against structure and analytical evidence.
- Calculate loganin quantities using measured content and the correct material basis.
- Select a supported dissolution, storage and retest procedure for a specified experiment.
- Compare lots for suitability as an analytical reference, isolated research substance or quantified extract constituent.
- Trace a reported occurrence or experimental effect to the material and evidence that support it.
Hazards and failure modes required Filled
- Mislabelled reference standards lead to wrong research results.
Standards and interfaces required Filled
- The Globally Harmonized System of Classification and Labelling of Chemicals, issued by the United Nations, provides the framework for assessing and communicating any identified hazards of supplied loganin under applicable national implementations.
Context of use required Filled
- Loganin is encountered in plant chemistry research as an iridoid glucoside involved in pathways leading to secologanin and certain alkaloids.
- Purified samples are used in analytical method development and investigations of plant extracts, biosynthesis and biological activity.
Sources Filled
- Wikidata item Q15426222: loganin - identity and sense of the item
- Wikipedia: Loganin - general description of the item
Open questions
- How should PubChem CIDs 87691 and 91727262 be reconciled against the full stereochemical definition, and which EC identifier is independently verified?
- Which validated analytical methods resolve loganin from the related iridoids and stereoisomers likely to occur in the relevant sample matrices?
- What reliable measurements establish solid form, water content, solvent-dependent solubility and thermal behavior without conflating melting with decomposition?
- What primary stability data establish loganin degradation pathways and defensible storage or solution-use limits under the intended conditions?
- Which current hazard, exposure-limit and regulatory records apply, and which biological claims remain limited to specific preclinical experiments?
Machine files
Provenance
thing registry research (pass 2) · unreviewed
Built from: models/things/publications/thing-q15426222/spec.json