Ontology mapping
- Primary identifier
-
CHEBI:62955 - Ontology label
- sodium 2-(N-morpholino)ethanesulfonate
- Notes
- Created from FEBA ontology enrichment workflow. Used in 4 FEBA media formulations.
Physicochemical roles
- Role
- BUFFER
- Confidence
- 0.8
- Evidence
- Reference type
- COMPUTATIONAL_PREDICTION
- Reference text
- Inferred from curated media-role name pattern
- Curator note
- Provisional role from a curated name-pattern rule; review recommended.
Synonyms (9)
| Synonym | Type | Source | Occurrences |
|---|---|---|---|
| 2-(N-Morpholino)ethanesulfonic acid sodium salt | EXACT_SYNONYM | kg_microbe | |
| 4-Morpholineethanesulfonic acid, sodium salt | EXACT_SYNONYM | kg_microbe | |
| 4-Morpholineethanesulfonic acid, sodium salt (1:1) | EXACT_SYNONYM | kg_microbe | |
| MES-Na | EXACT_SYNONYM | kg_microbe | |
| Sodium 4-morpholin-1-ylethylsulphonate | EXACT_SYNONYM | kg_microbe | |
| sodium 2-(N-morpholino)ethanesulfonate | EXACT_SYNONYM | kg_microbe | |
| sodium 2-(morpholin-4-yl)ethanesulfonate | EXACT_SYNONYM | kg_microbe | |
| sodium 2-morpholin-4-ylethanesulfonate | EXACT_SYNONYM | kg_microbe | |
| sodium MES | EXACT_SYNONYM | kg_microbe |
Chemical properties
- Cas rn
- 71119-23-8
- Data source
- FEBA ontology enrichment (via PubChem)
- Retrieval date
- 2026-04-07T10:19:42.382798+00:00
- Molecular formula
- C6H12NO4S.Na
- Inchi
- InChI=1S/C6H13NO4S.Na/c8-12(9,10)6-3-7-1-4-11-5-2-7;/h1-6H2,(H,8,9,10);/q;+1/p-1
- Smiles
- O=S(=O)([O-])CCN1CCOCC1.[Na+]
Evidence (1)
CAS_RN_CROSS_REFERENCE
via PubChem
ChEBI ID CHEBI:62955 found via PubChem CAS-RN cross-reference
Occurrence statistics
- Total occurrences
- 4
- Distinct media
- 4
Curation history
| Timestamp | Curator | Action | New status | Changes |
|---|---|---|---|---|
| 2026-04-07T10:19:42.382784+00:00 | feba_ontology_enrichment_batch | CREATED | MAPPED | Created ingredient file from FEBA ontology enrichment batch with ChEBI ID CHEBI:62955 |
| 2026-04-18T00:00:00+00:00 | cbclaw_kg_microbe_sweep LLM | ADDED_SYNONYMS | MAPPED | Added 9 synonyms from kg-microbe P4.4 enrichment: 2-(N-Morpholino)ethanesulfonic acid sodium salt, 4-Morpholineethanesulfonic acid, sodium salt, 4-Morpholineethanesulfonic acid, sodium salt (1:1), MES-Na, Sodium 4-morpholin-1-ylethylsulphonate, ... (4 more) |
| 2026-05-01T07:35:34.560703+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (CHEBI primary) | |
| 2026-05-01T08:08:30.591468+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_CHEBI_CHEMISTRY | molecular_formula=C6H12NO4S.Na; inchi=InChI=1S/C6H13NO4S.Na/c8-12(9,10)6-3-7-1-4-11-5-2-; smiles=O=S(=O)([O-])CCN1CCOCC1.[Na+] | |
| 2026-05-02T03:12:15.880702+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) | |
| 2026-06-03T02:06:01.744106+00:00 | infer_roles_from_name_lists | ANNOTATED | Added media role: BUFFER (confidence: 0.80) | |
| 2026-07-20T00:00:00+00:00 | migrate_media_roles_to_facets | ANNOTATED | Migrated legacy media_roles to role facets (#128): BUFFER -> physicochemical_roles.BUFFER |