1,1'-isophthaloylbiscaprolactam
Everything that changed this flow. Back to the flow
87849560-4a7b-4543-9640-0da88038e7f0
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=1,1'-isophthaloylbiscaprolactam||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['pubchem']; cas_sources={'7381-13-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-444dc192801b7bdc: {'7381-13-7': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 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=['7381-13-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[81857, 252967]; selected_pubchem_cids=[81857]; 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 |
|---|---|---|---|---|---|
| 13,489 | bootstrap_labels | prefLabel | — | [{"@value":"1,1'-isophthaloylbiscaprolactam","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 13,490 | bootstrap_labels | name | 1,1'-isophthaloylbiscaprolactam | — | Purged legacy name field to enforce prefLabel usage |
| 13,491 | bootstrap_labels | synonyms | ["organic","2h-azepin-2-one,1,1'","-(1,3-phenylenedicarbonyl)bis[hexahydro-","ipbcothernames1,1'","-isophthaloy… | [] | Removed legacy synonyms field in favor of structured labels |
| 130,352 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 130,353 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 217,801 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 239,969 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,970 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,971 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J421.857D","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['7381-13-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[81857, 252967]; selected_pubchem_cids=[81857]; 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 |
| 252,002 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | rdkit_pre_consensus from 'C1CCC(=O)N(CC1)C(=O)C2=CC(=CC=C2)C(=O)N3CCCCCC3=O'; added: molecular_mass, monoisotopic_mass |
| 258,058 | consensus_match | altLabel | [] | [{"@value":"1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2<em>H</em>-azepin-2-one]","@language":"en","source":{"prov:was… | group_key=1,1'-isophthaloylbiscaprolactam||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=7381-13-7; added Common Chemistry CAS names as altLabel: 1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2<em>H</em>-azepin-2-one], 1,1′-Isophthaloylbiscaprolactam, 1,1′-[1,3-Phenylenedi(carbonyl)]diazepan-2-one, 1,1′-isophthaloylbis(azepan-2-one), 1-[3-(2-Oxoazepane-1-carbonyl)benzoyl]azepan-2-one, 2<em>H</em>-Azepin-2-one, 1,1′-(1,3-phenylenedicarbonyl)bis[hexahydro-, 2<em>H</em>-Azepin-2-one, 1,1′-isophthaloylbis[hexahydro-, <em>N</em>,<em>N</em>′-Isophthaloylbis(caprolactam), <em>N</em>,<em>N</em>′-Isophthaloylbis(ε-caprolactam), <em>N</em>,<em>N</em>′-Isophthaloyldicaprolactam, Isophthaloyl-bis-ε-caprolactam, Isophthaloylbis(<em>N</em>-caprolactam), Isophthaloylbiscaprolactam; object_uuid=fo-444dc192801b7bdc |
| 258,059 | consensus_match | cas_match_labels | — | {"7381-13-7":"exactMatch"} | group_key=1,1'-isophthaloylbiscaprolactam||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['pubchem']; cas_sources={'7381-13-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-444dc192801b7bdc: {'7381-13-7': 'exactMatch'} |
| 277,213 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2H-azepin-2-one]' |
| 283,875 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | rdkit_post_consensus from 'O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,715 | dedupe_altlabels | altLabel | [{"@value":"1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2<em>H</em>-azepin-2-one]","@language":"en","source":{"prov:was… | [{"@value":"1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2H-azepin-2-one]","@language":"en","source":{"prov:wasGenerated… | Deduplicated altLabel values and removed entries matching prefLabel |
| 346,196 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/87849560-4a7b-… | associations resolved on the elementary layer |
| 391,564 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H24N2O4… | typed the way the ontology types it |
| 399,646 | 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/20260820T0738569779880000/13489 | prefLabel | ef:agent/bootstrap_labels | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v0 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v1 |
| ef:activity/change/20260820T0738569779880000/13490 | name | ef:agent/bootstrap_labels | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v1 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v2 |
| ef:activity/change/20260820T0738569779880000/13491 | synonyms | ef:agent/bootstrap_labels | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v2 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v3 |
| ef:activity/change/20260820T0738569779880000/130352 | context | ef:agent/default_context_mapping | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v3 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v4 |
| ef:activity/change/20260820T0738569779880000/130353 | context_iri | ef:agent/default_context_mapping | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v4 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v5 |
| ef:activity/change/20260820T0738569779880000/217801 | unit_iri | ef:agent/unit_normalization | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v5 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v6 |
| ef:activity/change/20260820T0738569779880000/239969 | properties | ef:agent/enrich_references | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v6 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v7 |
| ef:activity/change/20260820T0738569779880000/239970 | skos_definition | ef:agent/enrich_references | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v7 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v8 |
| ef:activity/change/20260820T0738569779880000/239971 | references | ef:agent/enrich_references | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v8 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v9 |
| ef:activity/change/20260820T0738569779880000/252002 | properties | ef:agent/rdkit_pre_consensus | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v9 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v10 |
| ef:activity/change/20260820T0738569779880000/258058 | altLabel | ef:agent/consensus_match | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v10 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v11 |
| ef:activity/change/20260820T0738569779880000/258059 | cas_match_labels | ef:agent/consensus_match | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v11 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v12 |
| ef:activity/change/20260820T0738569779880000/277213 | properties | ef:agent/opsin_iupac | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v12 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v13 |
| ef:activity/change/20260820T0738569779880000/283875 | properties | ef:agent/rdkit_post_consensus | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v13 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v14 |
| ef:activity/change/20260820T0738569779880000/292715 | altLabel | ef:agent/dedupe_altlabels | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v14 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v15 |
| ef:activity/change/20260820T0738569779880000/346196 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v15 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v16 |
| ef:activity/change/20260820T0738569779880000/391564 | properties | ef:agent/normalise_property_values | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v16 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v17 |
| ef:activity/change/20260820T0738569779880000/399646 | types | ef:agent/link_flows_to_their_substance | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v17 | ef:flow/87849560-4a7b-4543-9640-0da88038e7f0/v18 |