CaSO4

CHEBI:31346 chemically defined MAPPED CHEBI EXACT_MATCH

Ontology mapping

Primary identifier
CHEBI:31346
Ontology label
calcium sulfate

Nutritional roles

Synonyms (4)

SynonymTypeSourceOccurrences
Role: Mineral source; Properties: Inorganic compound, Complex component, Defined component RAW_TEXT CultureMech
Calcium sulfate EXACT_SYNONYM kg_microbe
Kalziumsulfat EXACT_SYNONYM kg_microbe
calcium sulphate EXACT_SYNONYM kg_microbe

Rejected enrichment labels (1)

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

Rejected labelDispositionSourceOccurrences
CaSO4・7H2O REJECTED_LABEL sssom_other_backfill

Chemical properties

Cas rn
7778-18-9
Data source
PubChem API
Retrieval date
2026-04-05T19:51:22.994558+00:00
Molecular formula
Ca.O4S
Inchi
InChI=1S/Ca.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2
Smiles
O=S(=O)([O-])[O-].[Ca+2]

Evidence (1)

DATABASE_MATCH via CultureMech

Imported from CultureMech pipeline, quality=DIRECT_MATCH

Occurrence statistics

Total occurrences
15
Distinct media
15

Curation history

TimestampCuratorActionNew statusChanges
2026-03-09T06:54:18.022301+00:00 import_from_culturemech IMPORTED MAPPED Initial import from CultureMech pipeline
2026-04-05T19:51:22.994606+00:00 fetch_cas_rn_from_pubchem ADDED_CAS_RN MAPPED Added CAS-RN:7778-18-9 from PubChem API via name lookup (CaSO4)
2026-04-18T00:00:00+00:00 cbclaw_kg_microbe_sweep LLM ADDED_SYNONYMS MAPPED Added 3 synonyms from kg-microbe P4.4 enrichment: Calcium sulfate, Kalziumsulfat, calcium sulphate
2026-05-01T07:35:32.647104+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (CHEBI primary)
2026-05-01T08:08:28.467371+00:00 auto_classify_ingredient_type AUTO_BACKFILL_CHEBI_CHEMISTRY molecular_formula=Ca.O4S; inchi=InChI=1S/Ca.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/; smiles=O=S(=O)([O-])[O-].[Ca+2]
2026-05-02T03:12:13.156401+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula))
2026-05-29T23:35:36.110422+00:00 extract_roles_from_synonyms ANNOTATED Added media role: MINERAL (confidence: 1.00)
2026-06-09T05:23:46.736381+00:00 correct_stale_ontology_labels.py CORRECTED ontology_label 'CaSO4' -> 'calcium sulfate': synced to canonical CHEBI label (preferred_term 'CaSO4' unchanged).
2026-07-20T00:00:00+00:00 migrate_media_roles_to_facets ANNOTATED Migrated legacy media_roles to role facets (#128): MINERAL -> nutritional_roles.SULFUR_SOURCE
2026-07-20T20:01:42.981644+00:00 migrate_media_roles_to_facets CORRECTED Added nutritional role(s) MINERAL_SOURCE missed by the initial #128 migration: the residual MINERAL_SOURCE bucket was suppressed whenever any other target existed, which dropped the bulk cation from salts whose other role describes the anion (e.g. MgSO4).
2026-08-27T03:16:39.518525+00:00 refresh_occurrence_statistics CORRECTED occurrence_statistics 9/9 -> 19/19 (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]
2026-09-02T17:40:44.716277+00:00 claude_sssom_surface_form_backfill ADDED_SYNONYMS Recovered 1 surface form(s) that the published SSSOM `other` carried but no curated record did, so a rebuild would have dropped them from KGX: 'CaSO4・7H2O'. Tokens already present on the kg-microbe ontology node were left out as redundant (#520).
2026-09-12T00:00:00+00:00 fix_malformed_hydrate_identities REJECTED_MALFORMED_HYDRATE_ALIASES MAPPED Marked malformed hydrate alias(es) as REJECTED_LABEL so they remain on their own #344 local identities only: 'CaSO4・7H2O'.
2026-09-12T00:00:00+00:00 fix_malformed_hydrate_identities REFRESHED_MALFORMED_SULFATE_OCCURRENCES MAPPED occurrence_statistics 19/19 -> 15/15 after moving CaSO4/K2SO4 x 7 H2O memberships off the anhydrous parent identifiers (#344).