Citric acid x H2O

CHEBI:31404 chemically defined MAPPED CHEBI EXACT_MATCH

Ontology mapping

Primary identifier
CHEBI:31404
Ontology label
Citric acid monohydrate

Nutritional roles

Synonyms (8)

SynonymTypeSourceOccurrences
Citric acid . H2O HYDRATE_FORM kg_microbe
Citric acid monohydrate EXACT_SYNONYM kg_microbe
Citric acid·H2O HYDRATE_FORM kg_microbe
H2cit RAW_TEXT sssom_other_backfill
citrate(1-) RAW_TEXT sssom_other_backfill
dihydrogen citrate RAW_TEXT sssom_other_backfill
Citric Acid•H2O RAW_TEXT MERGED_FROM_CHEBI:30769 (#652)
Citric Acid•H2O(Fisher A 104) RAW_TEXT MERGED_FROM_CHEBI:30769 (#652)

Chemical properties

Cas rn
5949-29-1
Data source
PubChem (via CHEBI:31404)
Retrieval date
2026-04-09T00:32:50.689620+00:00
Molecular formula
C6H8O7.H2O
Inchi
InChI=1S/C6H8O7.H2O/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);1H2
Smiles
O.O=C(O)CC(O)(CC(=O)O)C(=O)O

Evidence (1)

DATABASE_MATCH via CultureMech

Imported from CultureMech pipeline, quality=DIRECT_MATCH

Occurrence statistics

Total occurrences
8
Distinct media
8

Curation history

TimestampCuratorActionNew statusChanges
2026-03-09T06:54:18.022301+00:00 import_from_culturemech IMPORTED MAPPED Initial import from CultureMech pipeline
2026-04-09T00:32:50.689620+00:00 enrich_mim_cas_rn_batch CAS_RN_ADDED MAPPED Added CAS-RN 5949-29-1 from PubChem (via CHEBI:31404)
2026-04-18T00:00:00+00:00 cbclaw_kg_microbe_sweep LLM ADDED_SYNONYMS MAPPED Added 3 synonyms from kg-microbe P4.4 enrichment: Citric acid . H2O, Citric acid monohydrate, Citric acid·H2O
2026-05-01T07:35:32.813813+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (CHEBI primary)
2026-05-01T08:08:28.660495+00:00 auto_classify_ingredient_type AUTO_BACKFILL_CHEBI_CHEMISTRY molecular_formula=C6H8O7.H2O; inchi=InChI=1S/C6H8O7.H2O/c7-3(8)1-6(13,5(11)12)2-4(9)10; smiles=O.O=C(O)CC(O)(CC(=O)O)C(=O)O
2026-05-02T03:12:13.409166+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula))
2026-06-03T03:22:14.584223+00:00 infer_roles_from_name_lists ANNOTATED Added media role: CARBON_SOURCE (confidence: 0.80)
2026-06-04T05:38:59.200546+00:00 infer_energy_source ANNOTATED Added media role: ENERGY_SOURCE (confidence: 0.70)
2026-06-09T05:23:46.743078+00:00 correct_stale_ontology_labels.py CORRECTED ontology_label 'Citric acid x H2O' -> 'Citric acid monohydrate': synced to canonical CHEBI label (preferred_term 'Citric acid x H2O' unchanged).
2026-07-20T00:00:00+00:00 migrate_media_roles_to_facets ANNOTATED Migrated legacy media_roles to role facets (#128): CARBON_SOURCE -> nutritional_roles.CARBON_SOURCE; ENERGY_SOURCE -> nutritional_roles.ENERGY_SOURCE
2026-08-27T03:16:39.518571+00:00 refresh_occurrence_statistics CORRECTED occurrence_statistics 2/2 -> 8/8 (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]
2026-09-02T22:41:49.137449+00:00 claude_sssom_surface_form_backfill ADDED_SYNONYMS Recovered 3 surface form(s) that the published SSSOM `other` carried but no curated record did, so a rebuild would have dropped them from KGX: 'H2cit'; 'citrate(1-)'; 'dihydrogen citrate'. Tokens already present on the kg-microbe ontology node were left out as redundant (#520).
2026-09-12T00:00:00+00:00 fix_hydrate_local_identities MERGED_FROM MAPPED Absorbed duplicate CHEBI:30769 Citric Acid•H2O; added 2 monohydrate source label(s) as RAW_TEXT synonym(s) and left anhydrous or bare-parenthetical labels on the rejected tombstone (#652).