Ontology mapping
- Primary identifier
-
cas:143314-17-4 - Ontology term
-
CHEBI:63895— ionic liquid - Ontology label
- ionic liquid
Rejected enrichment labels (2)
Provenance-only candidates: these are not synonyms and do not resolve to this record.
| Rejected label | Disposition | Source | Occurrences |
|---|---|---|---|
| 1-ethyl-3-methyl-1H-imidazol-3-ium | REJECTED_LABEL | chebi_synonym_review | |
| 1-ethyl-3-methylimidazolium lysine | REJECTED_LABEL | mappings/ingredient_mappings.sssom.tsv |
Chemical properties
- Cas rn
- 143314-17-4
- Data source
- CultureBotHT compounds_to_cas.csv
- Retrieval date
- 2026-04-29T06:51:33.117170+00:00
- Molecular formula
- C8H14N2O2
- Smiles
- CCN1C=C[N+](=C1)C.CC(=O)[O-]
- Inchi
- InChI=1S/C6H11N2.C2H4O2/c1-3-8-5-4-7(2)6-8;1-2(3)4/h4-6H,3H2,1-2H3;1H3,(H,3,4)/q+1;/p-1
- Pubchem cid
- 11658353
Evidence (3)
Imported from CultureBotHT. CAS-RN 143314-17-4 present, but no CHEBI entry exists (checked OAK CHEBI sqlite + PubChem CID synonyms). FEBA/Hans80 panels: FEBA_stress. Curator can promote to a CHEBI primary if/when CHEBI adds the term.
SUPERSEDED (#312): Parent class identified via stem-substring; matched_via='1-ethyl-3-methylimidazolium acetate'
parent CHEBI:61326 ('1-ethyl-3-methylimidazolium') -> CHEBI:63895 ('ionic liquid'). The record is the neutral salt (CAS 143314-17-4, two-fragment SMILES). CHEBI:61326 '1-ethyl-3-methylimidazolium' is the bare cation, C6H11N2 charge +1: a component of the salt, not a broader term for it (Section 6). ChEBI has no term for the acetate salt, so the closest broader class is CHEBI:63895 'ionic liquid', the parent the sibling record 1-ethyl-3-methylimidazolium_Lysine already uses. cas: identity, NARROW_MATCH grade and both registry rows unchanged (Section 3 step 2).
Occurrence statistics
- Total occurrences
- 0
- Distinct media
- 0
Curation history
| Timestamp | Curator | Action | New status | Changes |
|---|---|---|---|---|
| 2026-04-29T06:51:33.117170+00:00 | audit_add_remaining_culturebotht | CREATED_FROM_CAS_FALLBACK | MAPPED | Created with cas:143314-17-4 as primary identifier; no CHEBI entry exists for this compound. |
| 2026-05-01T07:35:31.659196+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (cas: primary (defined chemical)) | |
| 2026-05-02T02:51:03.001057+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_PUBCHEM_CHEMISTRY | molecular_formula=C8H14N2O2; smiles=CCN1C=C[N+](=C1)C.CC(=O)[O-]; inchi=InChI=1S/C6H11N2.C2H4O2/c1-3-8-5-4-7(2)6-8;1-2(3)4 | |
| 2026-05-02T03:12:11.759811+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) | |
| 2026-05-02T04:35:53.785633+00:00 | backfill_parent_terms | BACKFILL_PARENT_CHEBI | set ontology_mapping parent=CHEBI:61326 (stem-substring) | |
| 2026-09-11T06:31:23.789310+00:00 | fix_salt_ion_identity_overclaims | REJECTED_ION_SYNONYMS | Marked cation/other-salt synonym(s) as REJECTED_LABEL so they cannot leak through SSSOM `other`: '1-ethyl-3-methyl-1H-imidazol-3-ium', '1-ethyl-3-methylimidazolium lysine' (#315). | |
| 2026-09-22T23:25:51.013985+00:00 | claude LLM | REGROUNDED_PARENT_TERM | MAPPED | broadMatch parent CHEBI:61326 ('1-ethyl-3-methylimidazolium') -> CHEBI:63895 ('ionic liquid') (#312). The record is the neutral salt (CAS 143314-17-4, two-fragment SMILES). CHEBI:61326 '1-ethyl-3-methylimidazolium' is the bare cation, C6H11N2 charge +1: a component of the salt, not a broader term for it (Section 6). ChEBI has no term for the acetate salt, so the closest broader class is CHEBI:63895 'ionic liquid', the parent the sibling record 1-ethyl-3-methylimidazolium_Lysine already uses. cas: identity, NARROW_MATCH grade and both registry rows unchanged (Section 3 step 2). |
Knowledge gaps & discussions (1)
KNOWLEDGE_GAPOPEN Knowledge gap for 1-ethyl-3-methylimidazolium acetate: Ionic liquids (ILs) have been used to replace organic solvents, thereby causing challenges for wastewater treatment.
Surfaced by the Europe PMC literature gap-signal scan (categories: future_work, limitations_barriers, unclear_unknown). Curator review required: set attaches_to, refine the prompt, and weigh the cited evidence.
4 evidence item(s)
Ionic liquids (ILs) have been used to replace organic solvents, thereby causing challenges for wastewater treatment.
Gap-signal sentence (limitations_barriers) from the cited abstract.
By focusing on the deconstruction and reassembly of nonedible agro-wastes, these methods address critical challenges such as resource competition, plastic pollution, and greenhouse gas emissions.
Gap-signal sentence (limitations_barriers) from the cited abstract.
These inherent structural complexities present significant challenges for its efficient isolation and precise transformation.
Gap-signal sentence (limitations_barriers) from the cited abstract.
However, challenges related to large-scale production, functionalization, regulatory frameworks, and safety concerns persist, necessitating further research and innovation.
Gap-signal sentence (future_work, limitations_barriers) from the cited abstract.