1,6-bis[2,2-dimethyl-3-(n-morpholino)-propylideneamino]-hexane
Everything that changed this flow. Back to the flow
90a5514e-0ab1-439e-8d72-f9e68f90774a
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=1,6-bis[2,2-dimethyl-3-(n-morpholino)-propylideneamino]-hexane||dimension=Environmental > media=Water > water_body=Long-term; group_sources=[]; cas_sources={'1217271-49-2': []}; assigned CAS labels from group consensus; object_uuid=fo-758220c6702176e6: {'1217271-49-2': '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 air > Emissions to air, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, 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=['1217271-49-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[89999256]; selected_pubchem_cids=[89999256]; 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 |
|---|---|---|---|---|---|
| 5,758 | bootstrap_labels | prefLabel | — | [{"@value":"1,6-bis[2,2-dimethyl-3-(n-morpholino)-propylideneamino]-hexane","@language":"en","source":{"prov:wasGenerat… | Bootstrapped prefLabel from legacy name field |
| 5,759 | bootstrap_labels | name | 1,6-bis[2,2-dimethyl-3-(n-morpholino)-propylideneamino]-hexane | — | Purged legacy name field to enforce prefLabel usage |
| 5,760 | bootstrap_labels | synonyms | ["organic","sikahardenermh","sikahã¤rtermh"] | [] | Removed legacy synonyms field in favor of structured labels |
| 135,732 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 135,733 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 215,262 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,722 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,723 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,724 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.205.171","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['1217271-49-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[89999256]; selected_pubchem_cids=[89999256]; 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 |
| 249,912 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | rdkit_pre_consensus from 'CC(C)(CN1CCOCC1)C=NCCCCCCN=CC(C)(C)CN2CCOCC2'; added: molecular_mass, monoisotopic_mass |
| 258,734 | consensus_match | altLabel | [] | [{"@value":"1,6-Hexanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>6</sup>-bis[2,2-dimethyl-3-(4-morpholinyl)propylid… | group_key=1,6-bis[2,2-dimethyl-3-(n-morpholino)-propylideneamino]-hexane||dimension=Environmental > media=Water > water_body=Long-term; cas=1217271-49-2; added Common Chemistry CAS names as altLabel: 1,6-Hexanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>6</sup>-bis[2,2-dimethyl-3-(4-morpholinyl)propylidene]-, <em>N</em><sup>1</sup>,<em>N</em><sup>6</sup>-Bis[2,2-dimethyl-3-(4-morpholinyl)propylidene]-1,6-hexanediamine; object_uuid=fo-758220c6702176e6 |
| 258,735 | consensus_match | cas_match_labels | — | {"1217271-49-2":"exactMatch"} | group_key=1,6-bis[2,2-dimethyl-3-(n-morpholino)-propylideneamino]-hexane||dimension=Environmental > media=Water > water_body=Long-term; group_sources=[]; cas_sources={'1217271-49-2': []}; assigned CAS labels from group consensus; object_uuid=fo-758220c6702176e6: {'1217271-49-2': 'exactMatch'} |
| 275,047 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,6-Hexanediamine, N1,N6-bis[2,2-dimethyl-3-(4-morpholinyl)propylidene]-' |
| 281,533 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | rdkit_post_consensus from 'CC(C)(C=NCCCCCCN=CC(C)(C)CN1CCOCC1)CN1CCOCC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,280 | dedupe_altlabels | altLabel | [{"@value":"1,6-Hexanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>6</sup>-bis[2,2-dimethyl-3-(4-morpholinyl)propylid… | [{"@value":"1,6-Hexanediamine, N1,N6-bis[2,2-dimethyl-3-(4-morpholinyl)propylidene]-","@language":"en","source":{"prov:… | Deduplicated altLabel values and removed entries matching prefLabel |
| 348,855 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/90a5514e-0ab1-… | associations resolved on the elementary layer |
| 389,348 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H46N4O2… | typed the way the ontology types it |
| 396,456 | 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/20260820T1812399309960000/5758 | prefLabel | ef:agent/bootstrap_labels | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v0 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v1 |
| ef:activity/change/20260820T1812399309960000/5759 | name | ef:agent/bootstrap_labels | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v1 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v2 |
| ef:activity/change/20260820T1812399309960000/5760 | synonyms | ef:agent/bootstrap_labels | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v2 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v3 |
| ef:activity/change/20260820T1812399309960000/135732 | context | ef:agent/default_context_mapping | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v3 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v4 |
| ef:activity/change/20260820T1812399309960000/135733 | context_iri | ef:agent/default_context_mapping | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v4 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v5 |
| ef:activity/change/20260820T1812399309960000/215262 | unit_iri | ef:agent/unit_normalization | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v5 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v6 |
| ef:activity/change/20260820T1812399309960000/232722 | properties | ef:agent/enrich_references | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v6 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v7 |
| ef:activity/change/20260820T1812399309960000/232723 | skos_definition | ef:agent/enrich_references | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v7 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v8 |
| ef:activity/change/20260820T1812399309960000/232724 | references | ef:agent/enrich_references | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v8 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v9 |
| ef:activity/change/20260820T1812399309960000/249912 | properties | ef:agent/rdkit_pre_consensus | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v9 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v10 |
| ef:activity/change/20260820T1812399309960000/258734 | altLabel | ef:agent/consensus_match | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v10 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v11 |
| ef:activity/change/20260820T1812399309960000/258735 | cas_match_labels | ef:agent/consensus_match | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v11 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v12 |
| ef:activity/change/20260820T1812399309960000/275047 | properties | ef:agent/opsin_iupac | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v12 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v13 |
| ef:activity/change/20260820T1812399309960000/281533 | properties | ef:agent/rdkit_post_consensus | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v13 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v14 |
| ef:activity/change/20260820T1812399309960000/292280 | altLabel | ef:agent/dedupe_altlabels | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v14 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v15 |
| ef:activity/change/20260820T1812399309960000/348855 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v15 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v16 |
| ef:activity/change/20260820T1812399309960000/389348 | properties | ef:agent/normalise_property_values | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v16 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v17 |
| ef:activity/change/20260820T1812399309960000/396456 | types | ef:agent/link_flows_to_their_substance | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v17 | ef:flow/90a5514e-0ab1-439e-8d72-f9e68f90774a/v18 |