Neodecanoic Acid, Zinc Salt
Everything that changed this flow. Back to the flow
c8a792b3-0351-4a65-bbef-e4b589d50c53
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 4 candidate structures, so no one mass describes it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 5 catalogue altLabel value(s): 'Bicat 1365' (trade name), 'Borchi Kat 0761' (trade name), 'HS 854' (grade code), 'HS 854 (salt)' (grade code), 'Tegokat 616' (trade name) |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=neodecanoicacid,zincsalt||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'27253-29-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b154a1562017b5cd: {'27253-29-8': 'exactMatch'} |
| concept_associations | 1 | carry_associations_onto_flows | associations resolved on the elementary layer |
| context | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['27253-29-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[117959, 13195113, 101505005, 117064711, 161242035]; selected_pubchem_cids=[117959, 101505005, 117064711, 161242035]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| skos_definition | 1 | enrich_references | Merged ChEBI/PubChem definitions into skos:definition |
| synonyms | 1 | bootstrap_labels | Removed legacy synonyms field in favor of structured labels |
| types | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| unit_iri | 1 | unit_normalization | Unit IRI set from normalization of 'kg' |
Where several steps wrote one field, the last one won — and the log below shows the sequence.
Changes
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 11,475 | bootstrap_labels | prefLabel | — | [{"@value":"neodecanoic acid, zinc salt","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Bootstrapped prefLabel from legacy name field |
| 11,476 | bootstrap_labels | name | neodecanoic acid, zinc salt | — | Purged legacy name field to enforce prefLabel usage |
| 11,477 | bootstrap_labels | synonyms | ["organometallic","zincneodecanoate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 168,644 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 168,645 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 217,144 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,770 | normalize_name_case | prefLabel | [{"@value":"neodecanoic acid, zinc salt","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | [{"@value":"Neodecanoic Acid, Zinc Salt","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 238,097 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=4) |
| 238,098 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,099 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.835.404E","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['27253-29-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[117959, 13195113, 101505005, 117064711, 161242035]; selected_pubchem_cids=[117959, 101505005, 117064711, 161242035]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| 251,453 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | rdkit_pre_consensus from 'CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].[Zn+2]'; added: molecular_mass, monoisotopic_mass |
| 269,799 | consensus_match | altLabel | [] | [{"@value":"Bicat 1365","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"cons… | group_key=neodecanoicacid,zincsalt||dimension=Environmental > media=Air > strata=Long-term; cas=27253-29-8; added Common Chemistry CAS names as altLabel: Bicat 1365, Bicat Z, Bicat ZM, Borchi Kat 0761, Borchi Kat 15, DriCAT 3020, HS 854, HS 854 (salt), Neodecanoic acid, zinc salt (2:1), Reaxis C 616, TIB KAT 616, Tegokat 616, Valikat ZN 1910, Zinc Ten-Cem, Zinc bis(neodecanoate), Zinc neodecanoate, ZincZap; object_uuid=fo-b154a1562017b5cd |
| 269,800 | consensus_match | cas_match_labels | — | {"27253-29-8":"exactMatch"} | group_key=neodecanoicacid,zincsalt||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'27253-29-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b154a1562017b5cd: {'27253-29-8': 'exactMatch'} |
| 276,632 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Zinc bis(neodecanoate)' |
| 283,257 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | rdkit_post_consensus from 'CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Zn+2]'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,964 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38O4Zn… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 4 candidate structures, so no one mass describes it |
| 289,624 | strip_catalogue_altlabels | altLabel | [{"@value":"Bicat 1365","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"cons… | [{"@value":"Bicat Z","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | Removed 5 catalogue altLabel value(s): 'Bicat 1365' (trade name), 'Borchi Kat 0761' (trade name), 'HS 854' (grade code), 'HS 854 (salt)' (grade code), 'Tegokat 616' (trade name) |
| 365,348 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c8a792b3-0351-… | associations resolved on the elementary layer |
| 398,840 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | the substance's answer, copied onto its flow |
PROV-O trail
19 activitiesOne activity per change: which version of the flow it consumed, and which it produced. The values are on the change with the same number — stored once, not twice.
| Activity | Field | Agent | Used | Generated |
|---|---|---|---|---|
| ef:activity/change/20260822T0600486828500000/11475 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v0 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v1 |
| ef:activity/change/20260822T0600486828500000/11476 | name | ef:agent/bootstrap_labels | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v1 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v2 |
| ef:activity/change/20260822T0600486828500000/11477 | synonyms | ef:agent/bootstrap_labels | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v2 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v3 |
| ef:activity/change/20260822T0600486828500000/168644 | context | ef:agent/default_context_mapping | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v3 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v4 |
| ef:activity/change/20260822T0600486828500000/168645 | context_iri | ef:agent/default_context_mapping | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v4 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v5 |
| ef:activity/change/20260822T0600486828500000/217144 | unit_iri | ef:agent/unit_normalization | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v5 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v6 |
| ef:activity/change/20260822T0600486828500000/223770 | prefLabel | ef:agent/normalize_name_case | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v6 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v7 |
| ef:activity/change/20260822T0600486828500000/238097 | properties | ef:agent/enrich_references | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v7 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v8 |
| ef:activity/change/20260822T0600486828500000/238098 | skos_definition | ef:agent/enrich_references | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v8 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v9 |
| ef:activity/change/20260822T0600486828500000/238099 | references | ef:agent/enrich_references | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v9 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v10 |
| ef:activity/change/20260822T0600486828500000/251453 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v10 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v11 |
| ef:activity/change/20260822T0600486828500000/269799 | altLabel | ef:agent/consensus_match | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v11 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v12 |
| ef:activity/change/20260822T0600486828500000/269800 | cas_match_labels | ef:agent/consensus_match | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v12 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v13 |
| ef:activity/change/20260822T0600486828500000/276632 | properties | ef:agent/opsin_iupac | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v13 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v14 |
| ef:activity/change/20260822T0600486828500000/283257 | properties | ef:agent/rdkit_post_consensus | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v14 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v15 |
| ef:activity/change/20260822T0600486828500000/286964 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v15 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v16 |
| ef:activity/change/20260822T0600486828500000/289624 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v16 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v17 |
| ef:activity/change/20260822T0600486828500000/365348 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v17 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v18 |
| ef:activity/change/20260822T0600486828500000/398840 | types | ef:agent/link_flows_to_their_substance | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v18 | ef:flow/c8a792b3-0351-4a65-bbef-e4b589d50c53/v19 |