Sodium Citrate

CHEBI:32142 chemically defined REJECTED CHEBI EXACT_MATCH

Ontology mapping

Primary identifier
CHEBI:32142
Ontology label
sodium citrate dihydrate
kg-microbe node
CHEBI:32142

Physicochemical roles

Synonyms (11)

SynonymTypeSourceOccurrences
Role: Buffer; Properties: Defined component, Simple component, Organic compound RAW_TEXT CultureMech
Role: Buffer; Properties: Organic compound, Defined component, Simple component RAW_TEXT CultureMech
Role: Buffer; Properties: Organic compound, Simple component, Defined component RAW_TEXT CultureMech
Role: Buffer; Properties: Simple component, Organic compound, Defined component RAW_TEXT CultureMech
Citronensaeure,Trinatrium-Salz-Dihydrat EXACT_SYNONYM kg_microbe
Na2citrate EXACT_SYNONYM kg_microbe
Na3Citrate EXACT_SYNONYM kg_microbe
Na3‐citrate EXACT_SYNONYM kg_microbe
Sodiumcitrate EXACT_SYNONYM kg_microbe
Trisodium citrate dehydrate EXACT_SYNONYM kg_microbe
trisodium 2-hydroxypropane-1,2,3-tricarboxylate--water (1/2) EXACT_SYNONYM kg_microbe

Rejected enrichment labels (1)

Provenance-only candidates: these are not synonyms and do not resolve to this record.

Rejected labelDispositionSourceOccurrences
trisodium 2-hydroxypropane-1,2,3-tricarboxylate REJECTED_LABEL chebi_synonym_review

Chemical properties

Cas rn
6132-04-3
Data source
CultureBotHT compounds_to_cas.csv
Retrieval date
2026-04-05T21:48:45.754074+00:00
Molecular formula
C6H5O7.3Na
Inchi
InChI=1S/C6H8O7.3Na/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;/q;3*+1/p-3
Smiles
O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]

Evidence (2)

DATABASE_MATCH via CultureMech

Imported from CultureMech pipeline, quality=DIRECT_MATCH

MANUAL_REVIEW via family_mismatch_fix

fix(family-mismatch): was CHEBI:32142 (sodium citrate dihydrate); generic "Sodium Citrate" name maps to the anhydrous parent CHEBI:53258 (matches sibling MIM:Trisodium_Citrate convention). CAS-RN 6132-04-3 is the dihydrate registry number — kept for synonymy but the canonical ontology mapping is the parent. Hydrate-specific records (Na3-citrate_X_2_H2o, Trisodium_Citrate_X_2_H2o) retain their own mappings.

Occurrence statistics

Total occurrences
0
Distinct media
0

Curation history

TimestampCuratorActionNew statusChanges
2026-03-09T06:54:18.022301+00:00 import_from_culturemech IMPORTED MAPPED Initial import from CultureMech pipeline
2026-04-05T21:48:45.754075+00:00 fetch_cas_rn_from_culturebot_csv ADDED_CAS_RN MAPPED Added CAS-RN:6132-04-3 from CultureBotHT compounds_to_cas.csv (matched: Sodium Citrate)
2026-04-05T21:48:45.756070+00:00 fetch_cas_rn_from_culturebot_csv ADDED_CAS_RN MAPPED Added CAS-RN:6132-04-3 from CultureBotHT compounds_to_cas.csv (matched: sodium citrate)
2026-04-18T00:00:00+00:00 cbclaw_kg_microbe_sweep LLM ADDED_SYNONYMS MAPPED Added 7 synonyms from kg-microbe P4.4 enrichment: Citronensaeure,Trinatrium-Salz-Dihydrat, Na2citrate, Na3Citrate, Na3‐citrate, Sodiumcitrate, ... (2 more)
2026-04-19T07:39:23.955331+00:00 audit_mim_merge MERGED_FROM_DUPLICATES MAPPED Absorbed 1 duplicate MIM record(s) into this one: Sodium_Citrate_3.yaml. Synonyms, curation_history, and occurrence counts were unioned/summed; winner selected by highest occurrence count with preferred_term readability tie-break.
2026-05-01T07:35:36.235927+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (CHEBI primary)
2026-05-01T08:08:32.324568+00:00 auto_classify_ingredient_type AUTO_BACKFILL_CHEBI_CHEMISTRY molecular_formula=C6H5O7.2H2O.3Na; inchi=InChI=1S/C6H8O7.3Na.2H2O/c7-3(8)1-6(13,5(11)12)2-4; smiles=O.O.O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Na+].[Na+
2026-05-02T03:12:18.346349+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula))
2026-05-02T15:00:00+00:00 family_mismatch_fix REMAPPED_ONTOLOGY CHEBI:32142 (sodium citrate dihydrate) → CHEBI:53258 (sodium citrate); generic ingredient name "Sodium Citrate" should use anhydrous parent (matches MIM:Trisodium_Citrate convention). Cleared chemical_properties molecular_formula/inchi/smiles (were dihydrate-specific) and kg_microbe_node_id for re-backfill against the new CHEBI. CAS-RN 6132-04-3 retained as a synonym registry but is technically the dihydrate's registry number.
2026-05-02T23:59:52.838836+00:00 auto_classify_ingredient_type AUTO_BACKFILL_CHEBI_CHEMISTRY molecular_formula=C6H5O7.3Na; inchi=InChI=1S/C6H8O7.3Na/c7-3(8)1-6(13,5(11)12)2-4(9)10; smiles=O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Na+].[Na+].[N
2026-05-29T23:35:36.112812+00:00 extract_roles_from_synonyms ANNOTATED Added media role: BUFFER (confidence: 1.00)
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
2026-08-13T00:00:00+00:00 reground_cas_specific_form MERGED_INTO Merged into CHEBI:32142 'Na3-citrate x 2 H2O'; its CAS 6132-04-3 denotes the dihydrate (#320). Tombstoned REJECTED, SSSOM rows dropped.
2026-08-15T00:00:00+00:00 fix_tombstone_pointers REFRESHED_TOMBSTONE_ONTOLOGY_ID ontology_id CHEBI:53258 -> CHEBI:32142 (#360). The merge set identifier and status but left ontology_mapping untouched, so this tombstone kept advertising a term it no longer asserts — anything indexing by ontology_id routed through it. Now agrees with the merge target 'Na3-citrate x 2 H2O'. Provenance is unaffected: what the record used to assert is in this history.
2026-09-09T00:00:00+00:00 fix_kg_microbe_node_id_drift CORRECTED kg_microbe_node_id CHEBI:53258 -> CHEBI:32142 (#554). The compatibility node id lagged a same-prefix identifier correction; the downstream node id must match the curated identifier unless a record intentionally crosses CURIE prefixes.
2026-09-23T06:21:57.674086+00:00 claude LLM REJECTED_WRONG_FORM_SYNONYMS REJECTED Retyped REJECTED_LABEL: 'trisodium 2-hydroxypropane-1,2,3-tricarboxylate' (EXACT_SYNONYM): the anhydrous trisodium citrate CHEBI:53258 name on the sodium citrate dihydrate CHEBI:32142 tombstone (#232). The token is kept as provenance only; it must not resolve, be exported, or enter the SSSOM other column.