NiCl2 x 6 H2O

CHEBI:53542 chemically defined REJECTED CHEBI EXACT_MATCH

Ontology mapping

Primary identifier
CHEBI:53542
Ontology label
nickel chloride hexahydrate
kg-microbe node
CHEBI:53542

Nutritional roles

Synonyms (17)

SynonymTypeSourceOccurrences
Role: Mineral source; Properties: Inorganic compound, Defined component, Simple component RAW_TEXT CultureMech
NiCl2 . 6H2O HYDRATE_FORM kg_microbe
NiCl2 x 6 H2O (0.1% w/v) HYDRATE_FORM kg_microbe
NiCl2 x 6H2O HYDRATE_FORM kg_microbe
NiCl2 x H2O HYDRATE_FORM kg_microbe
NiCl2 · 6H2O HYDRATE_FORM kg_microbe
NiCl2.6H2O HYDRATE_FORM kg_microbe
NiCl2x6H2O HYDRATE_FORM kg_microbe
NiCl2·6H2O HYDRATE_FORM kg_microbe
NiCl2⋅6H2O HYDRATE_FORM kg_microbe
NiCl2・6H2O HYDRATE_FORM kg_microbe
NiCl2・H2O HYDRATE_FORM kg_microbe
NiCl2 ∙ 6 H2O HYDRATE_FORM kg_microbe_via_hydration_routing
NiCl2∙6H2O HYDRATE_FORM kg_microbe_via_hydration_routing
Role: Mineral source; Properties: Defined component, Inorganic compound, Simple component RAW_TEXT CultureMech
Role: Mineral source; Properties: Defined component, Simple component, Inorganic compound RAW_TEXT CultureMech
Role: Mineral source; Properties: Solution, Defined component RAW_TEXT CultureMech

Rejected enrichment labels (7)

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

Rejected labelDispositionSourceOccurrences
NiCl2 x 2 H2O REJECTED_LABEL kg_microbe
NiCl2 x 2H2O REJECTED_LABEL kg_microbe
NiCl2 x 5 H2O REJECTED_LABEL kg_microbe
NiCl2·2H2O REJECTED_LABEL kg_microbe
NiCl2・5H2O REJECTED_LABEL kg_microbe
nickel(2+) chloride REJECTED_LABEL chebi_synonym_review
nickel(II) chloride REJECTED_LABEL chebi_synonym_review

Chemical properties

Cas rn
7791-20-0
Data source
OAK/CHEBI xref
Retrieval date
2026-04-19T07:35:12.781730+00:00
Molecular formula
Cl2Ni
Inchi
InChI=1S/2ClH.Ni/h2*1H;/q;;+2/p-2
Smiles
[Cl][Ni][Cl]

Evidence (1)

DATABASE_MATCH via CultureMech

Imported from CultureMech pipeline, quality=DIRECT_MATCH

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
2026-04-05T21:48:45.587450+00:00 fetch_cas_rn_from_culturebot_csv ADDED_CAS_RN MAPPED Added CAS-RN:7791-20-0 from CultureBotHT compounds_to_cas.csv (matched: NiCl2·6H2O)
2026-04-05T23:46:46.255137+00:00 fetch_cas_rn_with_preprocessing ADDED_CAS_RN MAPPED Added CAS-RN:7718-54-9 from PubChem API (ontology label) via name preprocessing (NiCl2 x 6 H2O (0.1% w/v))
2026-04-09T00:32:50.689620+00:00 enrich_mim_cas_rn_batch CAS_RN_ADDED MAPPED Added CAS-RN 7791-20-0 from CultureBotHT/compounds_to_cas.csv
2026-04-18T00:00:00+00:00 cbclaw_kg_microbe_sweep LLM ADDED_SYNONYMS MAPPED Added 16 synonyms from kg-microbe P4.4 enrichment: NiCl2 . 6H2O, NiCl2 x 2 H2O, NiCl2 x 2H2O, NiCl2 x 5 H2O, NiCl2 x 6 H2O (0.1% w/v), ... (11 more)
2026-04-18T00:00:00+00:00 cbclaw_kg_microbe_sweep LLM ADDED_SYNONYMS MAPPED Added 16 synonyms from kg-microbe P4.4 enrichment: NiCl2 . 6H2O, NiCl2 x 2 H2O, NiCl2 x 2H2O, NiCl2 x 5 H2O, NiCl2 x 6 H2O, ... (11 more)
2026-04-19T06:30:07.230267+00:00 audit_p44_hydration_routing ADDED_SYNONYMS_VIA_HYDRATION_ROUTING MAPPED Added 2 synonyms re-routed from anhydrous/hydrate sibling records (Nicl26h2o.yaml): NiCl2 ∙ 6 H2O, NiCl2∙6H2O
2026-04-19T06:30:07.230267+00:00 audit_p44_hydration_routing ADDED_SYNONYMS_VIA_HYDRATION_ROUTING MAPPED Added 2 synonyms re-routed from anhydrous/hydrate sibling records (Nicl2_X_6_H2o.yaml): NiCl2 ∙ 6 H2O, NiCl2∙6H2O
2026-04-19T07:35:12.782058+00:00 audit_mim_merge MERGED_FROM_DUPLICATES MAPPED Absorbed 2 duplicate MIM record(s) into this one: Nicl26h2o.yaml, Nicl2_X_6_H2o_01_Wv.yaml. Synonyms, curation_history, and occurrence counts were unioned/summed; winner selected by highest occurrence count with preferred_term readability tie-break.
2026-04-19T07:35:12.781730+00:00 audit_resolve_risky_cas_rn RESOLVED_CAS_RN_CONFLICT MAPPED CAS-RN conflict across merged group (7718-54-9|7791-20-0) resolved via OAK canonical xref: 7718-54-9 (match)
2026-05-01T07:35:35.539923+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (CHEBI primary)
2026-05-01T08:08:31.638188+00:00 auto_classify_ingredient_type AUTO_BACKFILL_CHEBI_CHEMISTRY molecular_formula=Cl2Ni; inchi=InChI=1S/2ClH.Ni/h2*1H;/q;;+2/p-2; smiles=[Cl][Ni][Cl]
2026-05-02T03:12:17.418481+00:00 auto_classify_ingredient_type AUTO_CLASSIFY_INGREDIENT_TYPE set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula))
2026-05-29T23:35:36.112463+00:00 extract_roles_from_synonyms ANNOTATED Added media role: MINERAL (confidence: 1.00)
2026-06-09T05:23:46.812823+00:00 correct_stale_ontology_labels.py CORRECTED ontology_label 'NiCl2 x 6 H2O' -> 'nickel dichloride': synced to canonical CHEBI label (preferred_term 'NiCl2 x 6 H2O' 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.TRACE_ELEMENT
2026-08-13T00:00:00+00:00 fix_hydrate_collapse MERGED_INTO Merged into CHEBI:53542 'Nickel (II) chloride hexahydrate'; occurrences transferred. Tombstoned REJECTED, SSSOM rows dropped (#321/#334).
2026-08-15T00:00:00+00:00 fix_tombstone_pointers REFRESHED_TOMBSTONE_ONTOLOGY_ID ontology_id CHEBI:34887 -> CHEBI:53542 (#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 'Nickel (II) chloride hexahydrate'. Provenance is unaffected: what the record used to assert is in this history.
2026-08-29T03:56:37.918985+00:00 hydrate_duplicate_merges CORRECTED cas_rn 7718-54-9 -> 7791-20-0. 7718-54-9 is the ANHYDROUS parent's CAS; 7791-20-0 is the dbxref on CHEBI:53542 nickel chloride hexahydrate, which this record is grounded to. A hydrate and its anhydrous parent are different substances with different formula weights (#334).
2026-09-09T00:00:00+00:00 fix_kg_microbe_node_id_drift CORRECTED kg_microbe_node_id CHEBI:34887 -> CHEBI:53542 (#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.
2026-09-22T20:41:14.285965+00:00 claude LLM REJECTED_PARENT_NAME_SYNONYMS Retyped names of the parent compound or of a different hydrate as provenance-only REJECTED_LABEL, because this record is a distinct salt, hydrate or tombstone form and the label index resolved the parent's name here (#232): 'NiCl2 x 2 H2O'; 'NiCl2 x 2H2O'; 'NiCl2 x 5 H2O'; 'NiCl2·2H2O'; 'NiCl2・5H2O'; 'nickel(2+) chloride'; 'nickel(II) chloride'. Preserved original text and source metadata. No identity, mapping, role, or remaining-synonym claim was adjudicated.