(trimethylenedinitrilo)tetrakisacetonitrile
Everything that changed this flow. Back to the flow
9a3344e7-d9d5-4d3d-a3fb-a2f260b70693
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 231416' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=(trimethylenedinitrilo)tetrakisacetonitrile||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'110057-45-9': []}; assigned CAS labels from group consensus; object_uuid=fo-f5f51ea0f59d0434: {'110057-45-9': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['110057-45-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[314171]; selected_pubchem_cids=[314171]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 20,781 | bootstrap_labels | prefLabel | — | [{"@value":"(trimethylenedinitrilo)tetrakisacetonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | Bootstrapped prefLabel from legacy name field |
| 20,782 | bootstrap_labels | name | (trimethylenedinitrilo)tetrakisacetonitrile | — | Purged legacy name field to enforce prefLabel usage |
| 20,783 | bootstrap_labels | synonyms | ["organic","pdtn"] | [] | Removed legacy synonyms field in favor of structured labels |
| 141,370 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 141,371 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 220,056 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 246,329 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 246,330 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,331 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.782.125J","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['110057-45-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[314171]; selected_pubchem_cids=[314171]; 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 |
| 253,848 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | rdkit_pre_consensus from 'C(CN(CC#N)CC#N)CN(CC#N)CC#N'; added: molecular_mass, monoisotopic_mass |
| 257,934 | consensus_match | altLabel | [] | [{"@value":"2,2′,2′′,2′′′-(1,3-Propanediyldinitrilo)tetrakis[acetonitrile]","@language":"en","source":{"prov:wasGenerat… | group_key=(trimethylenedinitrilo)tetrakisacetonitrile||dimension=Environmental > media=Water > water_body=Ocean; cas=110057-45-9; added Common Chemistry CAS names as altLabel: 2,2′,2′′,2′′′-(1,3-Propanediyldinitrilo)tetrakis[acetonitrile], Acetonitrile, (trimethylenedinitrilo)tetra-, Acetonitrile, 2,2′,2′′,2′′′-(1,3-propanediyldinitrilo)tetrakis-, NSC 231416; object_uuid=fo-f5f51ea0f59d0434 |
| 257,935 | consensus_match | cas_match_labels | — | {"110057-45-9":"exactMatch"} | group_key=(trimethylenedinitrilo)tetrakisacetonitrile||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'110057-45-9': []}; assigned CAS labels from group consensus; object_uuid=fo-f5f51ea0f59d0434: {'110057-45-9': 'exactMatch'} |
| 279,064 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(trimethylenedinitrilo)tetrakisacetonitrile' |
| 285,893 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | rdkit_post_consensus from 'N#CCN(CC#N)CCCN(CC#N)CC#N'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,402 | strip_catalogue_altlabels | altLabel | [{"@value":"2,2′,2′′,2′′′-(1,3-Propanediyldinitrilo)tetrakis[acetonitrile]","@language":"en","source":{"prov:wasGenerat… | [{"@value":"2,2′,2′′,2′′′-(1,3-Propanediyldinitrilo)tetrakis[acetonitrile]","@language":"en","source":{"prov:wasGenerat… | Removed 1 catalogue altLabel value(s): 'NSC 231416' (registry code) |
| 351,706 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9a3344e7-d9d5-… | associations resolved on the elementary layer |
| 393,447 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14N6"]… | typed the way the ontology types it |
| 402,400 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260820T1416470405690000/20781 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v0 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v1 |
| ef:activity/change/20260820T1416470405690000/20782 | name | ef:agent/bootstrap_labels | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v1 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v2 |
| ef:activity/change/20260820T1416470405690000/20783 | synonyms | ef:agent/bootstrap_labels | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v2 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v3 |
| ef:activity/change/20260820T1416470405690000/141370 | context | ef:agent/default_context_mapping | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v3 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v4 |
| ef:activity/change/20260820T1416470405690000/141371 | context_iri | ef:agent/default_context_mapping | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v4 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v5 |
| ef:activity/change/20260820T1416470405690000/220056 | unit_iri | ef:agent/unit_normalization | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v5 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v6 |
| ef:activity/change/20260820T1416470405690000/246329 | properties | ef:agent/enrich_references | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v6 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v7 |
| ef:activity/change/20260820T1416470405690000/246330 | skos_definition | ef:agent/enrich_references | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v7 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v8 |
| ef:activity/change/20260820T1416470405690000/246331 | references | ef:agent/enrich_references | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v8 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v9 |
| ef:activity/change/20260820T1416470405690000/253848 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v9 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v10 |
| ef:activity/change/20260820T1416470405690000/257934 | altLabel | ef:agent/consensus_match | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v10 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v11 |
| ef:activity/change/20260820T1416470405690000/257935 | cas_match_labels | ef:agent/consensus_match | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v11 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v12 |
| ef:activity/change/20260820T1416470405690000/279064 | properties | ef:agent/opsin_iupac | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v12 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v13 |
| ef:activity/change/20260820T1416470405690000/285893 | properties | ef:agent/rdkit_post_consensus | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v13 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v14 |
| ef:activity/change/20260820T1416470405690000/291402 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v14 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v15 |
| ef:activity/change/20260820T1416470405690000/351706 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v15 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v16 |
| ef:activity/change/20260820T1416470405690000/393447 | properties | ef:agent/normalise_property_values | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v16 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v17 |
| ef:activity/change/20260820T1416470405690000/402400 | types | ef:agent/link_flows_to_their_substance | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v17 | ef:flow/9a3344e7-d9d5-4d3d-a3fb-a2f260b70693/v18 |