Ontology mapping
- Primary identifier
-
CHEBI:132751 - Ontology label
- thiamine hydrochloride dihydrate
Nutritional roles
- Role
- VITAMIN_SOURCE
- Confidence
- 1.0
- Evidence
- Reference text
- CultureMech database (579 occurrences as 'Vitamin')
- Reference type
- DATABASE_ENTRY
- Url
- https://github.com/CultureBotAI/CultureMech
- Excerpt
- Role: Vitamin; Properties: Organic compound, Defined component, Simple component
- Curator note
- Widespread use in media formulations (579 occurrences). High confidence based on 'Defined component' property.
Synonyms (10)
| Synonym | Type | Source | Occurrences |
|---|---|---|---|
| Role: Vitamin; Properties: Organic compound, Defined component, Simple component | RAW_TEXT | CultureMech | |
| Thiamine-HCl·2H2O | HYDRATE_FORM | kg_microbe | |
| thiamine chloride hydrochloride dihydrate | EXACT_SYNONYM | kg_microbe | |
| thiamine dichloride dihydrate | EXACT_SYNONYM | kg_microbe | |
| thiamine hydrochloride dihydrate | EXACT_SYNONYM | kg_microbe | |
| thiamine(2+) dichloride dihydrate | EXACT_SYNONYM | kg_microbe | |
| 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride hydrochloride--water (1/2) | EXACT_SYNONYM | chebi_synonym_review | |
| 3-[(4-azaniumyl-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride--water (1/2) | EXACT_SYNONYM | chebi_synonym_review | |
| Thiamine・HCl・2H2O | RAW_TEXT | culturemech:output/ingredient_occurrences.tsv | |
| Thiamine·HCl·2H2O | RAW_TEXT | culturemech:output/ingredient_occurrences.tsv |
Chemical properties
- Cas rn
- 13465-05-9
- Data source
- PubChem API (preprocessed)
- Retrieval date
- 2026-04-05T23:47:06.145091+00:00
- Molecular formula
- C12H18N4OS.2Cl.2H2O
- Inchi
- InChI=1S/C12H17N4OS.2ClH.2H2O/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;;;;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);2*1H;2*1H2/q+1;;;;/p-1
- Smiles
- Cc1ncc(C[n+]2csc(CCO)c2C)c([NH3+])n1.O.O.[Cl-].[Cl-]
Evidence (1)
DATABASE_MATCH
via CultureMech
Imported from CultureMech pipeline, quality=DIRECT_MATCH
Occurrence statistics
- Total occurrences
- 441
- Distinct media
- 441
Curation history
| Timestamp | Curator | Action | New status | Changes |
|---|---|---|---|---|
| 2026-03-09T06:54:18.022301+00:00 | import_from_culturemech | IMPORTED | MAPPED | Initial import from CultureMech pipeline |
| 2026-04-05T23:47:06.145100+00:00 | fetch_cas_rn_with_preprocessing | ADDED_CAS_RN | MAPPED | Added CAS-RN:13465-05-9 from PubChem API (preprocessed) via name preprocessing (Thiamine-HCl x 2 H2O) |
| 2026-04-18T00:00:00+00:00 | cbclaw_kg_microbe_sweep LLM | ADDED_SYNONYMS | MAPPED | Added 5 synonyms from kg-microbe P4.4 enrichment: Thiamine-HCl·2H2O, thiamine chloride hydrochloride dihydrate, thiamine dichloride dihydrate, thiamine hydrochloride dihydrate, thiamine(2+) dichloride dihydrate |
| 2026-05-01T07:35:36.594590+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (CHEBI primary) | |
| 2026-05-01T08:08:32.668072+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_CHEBI_CHEMISTRY | molecular_formula=C12H18N4OS.2Cl.2H2O; inchi=InChI=1S/C12H17N4OS.2ClH.2H2O/c1-8-11(3-4-17)18-7-; smiles=Cc1ncc(C[n+]2csc(CCO)c2C)c([NH3+])n1.O.O.[Cl-].[Cl | |
| 2026-05-02T03:12:18.822644+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) | |
| 2026-05-29T23:35:36.113146+00:00 | extract_roles_from_synonyms | ANNOTATED | Added media role: VITAMIN_SOURCE (confidence: 1.00) | |
| 2026-06-09T05:23:46.843119+00:00 | correct_stale_ontology_labels.py | CORRECTED | ontology_label 'Thiamine-HCl x 2 H2O' -> 'thiamine hydrochloride dihydrate': synced to canonical CHEBI label (preferred_term 'Thiamine-HCl x 2 H2O' unchanged). | |
| 2026-07-20T00:00:00+00:00 | migrate_media_roles_to_facets | ANNOTATED | Migrated legacy media_roles to role facets (#128): VITAMIN_SOURCE -> nutritional_roles.VITAMIN_SOURCE | |
| 2026-08-27T03:16:39.519956+00:00 | refresh_occurrence_statistics | CORRECTED | occurrence_statistics 50/579 -> 441/441 (media_count/total_occurrences), derived from distinct CultureMech recipe ids in the #337 occurrence table. The prior values came from the importer retired in #453, whose media_count counted a list truncated to 50 examples (#449). [source=ingredient_occurrences.tsv culturemech_rev=15a4da5c08 rows=194137 distinct_recipes=15257] | |
| 2026-08-30T04:48:06.233536+00:00 | claude_culturemech_alias_backfill | ADDED_SYNONYMS | Added 2 CultureMech recipe surface form(s) that folded onto this record's published label but were absent from MIM's label index, so CultureMech could not resolve them: 'Thiamine・HCl・2H2O' (x8 CultureMech mentions); 'Thiamine·HCl·2H2O' (x1 CultureMech mentions). Source: culturemech:output/ingredient_occurrences.tsv. |