1,2-dinitrobenzene
Everything that changed this flow. Back to the flow
bba14a7c-301b-4862-9019-d66cb3d21fdc
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 60682' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1,2-dinitrobenzene||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'528-29-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97a29b184365f442: {'528-29-0': '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 non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 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=['528-29-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_34053']; candidate_pubchem_cids=[10707, 218039]; selected_pubchem_cids=[10707]; 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 |
|---|---|---|---|---|---|
| 15,324 | bootstrap_labels | prefLabel | — | [{"@value":"1,2-dinitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 15,325 | bootstrap_labels | name | 1,2-dinitrobenzene | — | Purged legacy name field to enforce prefLabel usage |
| 15,326 | bootstrap_labels | synonyms | ["1,2-Dinitrobenzol","AC1L1VRZ","AC1Q1WUN","AKOS000120631","Benzene, 1,2-dinitro-","Benzene, 1,2-dinitro- (9CI)","Benze… | [] | Removed legacy synonyms field in favor of structured labels |
| 161,060 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 161,061 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 218,382 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,639 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 241,640 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,641 | enrich_references | references | [] | [{"@id":"beilstein:642224","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['528-29-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_34053']; candidate_pubchem_cids=[10707, 218039]; selected_pubchem_cids=[10707]; 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 |
| 252,483 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | rdkit_pre_consensus from 'C1=CC=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-]'; added: monoisotopic_mass |
| 256,411 | chebi_altlabels | altLabel | [] | [{"@value":"1,2-Dinitrobenzol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 258,436 | consensus_match | altLabel | [{"@value":"1,2-Dinitrobenzol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | [{"@value":"1,2-Dinitrobenzol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | group_key=1,2-dinitrobenzene||dimension=Environmental > media=Water > water_body=Unknown; cas=528-29-0; added Common Chemistry CAS names as altLabel: Benzene, 1,2-dinitro-, Benzene, <em>o</em>-dinitro-, NSC 60682, Ortho-dinitrobenzene; object_uuid=fo-97a29b184365f442 |
| 258,437 | consensus_match | cas_match_labels | — | {"528-29-0":"exactMatch"} | group_key=1,2-dinitrobenzene||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'528-29-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97a29b184365f442: {'528-29-0': 'exactMatch'} |
| 277,678 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,2-dinitrobenzene' |
| 284,374 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | rdkit_post_consensus from 'O=[N+]([O-])c1ccccc1[N+](=O)[O-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,373 | strip_catalogue_altlabels | altLabel | [{"@value":"1,2-Dinitrobenzol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | [{"@value":"1,2-Dinitrobenzol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | Removed 1 catalogue altLabel value(s): 'NSC 60682' (registry code) |
| 361,547 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/bba14a7c-301b-… | associations resolved on the elementary layer |
| 392,026 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N2O4"]… | typed the way the ontology types it |
| 400,313 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260820T1812399309960000/15324 | prefLabel | ef:agent/bootstrap_labels | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v0 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v1 |
| ef:activity/change/20260820T1812399309960000/15325 | name | ef:agent/bootstrap_labels | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v1 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v2 |
| ef:activity/change/20260820T1812399309960000/15326 | synonyms | ef:agent/bootstrap_labels | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v2 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v3 |
| ef:activity/change/20260820T1812399309960000/161060 | context | ef:agent/default_context_mapping | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v3 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v4 |
| ef:activity/change/20260820T1812399309960000/161061 | context_iri | ef:agent/default_context_mapping | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v4 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v5 |
| ef:activity/change/20260820T1812399309960000/218382 | unit_iri | ef:agent/unit_normalization | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v5 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v6 |
| ef:activity/change/20260820T1812399309960000/241639 | properties | ef:agent/enrich_references | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v6 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v7 |
| ef:activity/change/20260820T1812399309960000/241640 | skos_definition | ef:agent/enrich_references | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v7 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v8 |
| ef:activity/change/20260820T1812399309960000/241641 | references | ef:agent/enrich_references | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v8 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v9 |
| ef:activity/change/20260820T1812399309960000/252483 | properties | ef:agent/rdkit_pre_consensus | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v9 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v10 |
| ef:activity/change/20260820T1812399309960000/256411 | altLabel | ef:agent/chebi_altlabels | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v10 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v11 |
| ef:activity/change/20260820T1812399309960000/258436 | altLabel | ef:agent/consensus_match | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v11 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v12 |
| ef:activity/change/20260820T1812399309960000/258437 | cas_match_labels | ef:agent/consensus_match | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v12 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v13 |
| ef:activity/change/20260820T1812399309960000/277678 | properties | ef:agent/opsin_iupac | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v13 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v14 |
| ef:activity/change/20260820T1812399309960000/284374 | properties | ef:agent/rdkit_post_consensus | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v14 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v15 |
| ef:activity/change/20260820T1812399309960000/290373 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v15 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v16 |
| ef:activity/change/20260820T1812399309960000/361547 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v16 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v17 |
| ef:activity/change/20260820T1812399309960000/392026 | properties | ef:agent/normalise_property_values | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v17 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v18 |
| ef:activity/change/20260820T1812399309960000/400313 | types | ef:agent/link_flows_to_their_substance | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v18 | ef:flow/bba14a7c-301b-4862-9019-d66cb3d21fdc/v19 |