2-Nitrobenzoic Acid
Everything that changed this flow. Back to the flow
f519c46c-70b6-4f71-9a18-3d80de2387d6
By field
14 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 9576' (registry code) |
| 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=2-nitrobenzoicacid||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'552-16-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6ba2c9c4db685643: {'552-16-9': '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 air > Emissions to non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 209-004-9 from CAS 552-16-9 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['552-16-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_25620']; candidate_pubchem_cids=[11087, 5159892]; selected_pubchem_cids=[11087]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 14,978 | bootstrap_labels | prefLabel | — | [{"@value":"2-Nitrobenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 14,979 | bootstrap_labels | name | 2-Nitrobenzoic acid | — | Purged legacy name field to enforce prefLabel usage |
| 14,980 | bootstrap_labels | synonyms | ["o-nitrobenzoic acid","ortho-nitrobenzoic acid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 197,112 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 197,113 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 218,274 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,547 | normalize_name_case | prefLabel | [{"@value":"2-Nitrobenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | [{"@value":"2-Nitrobenzoic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 226,967 | ec_cross_check | ec_numbers | [] | ["209-004-9"] | Resolved from EC-inventory: 209-004-9 from CAS 552-16-9 |
| 241,333 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 241,334 | enrich_references | skos_definition | — | [{"@value":"A nitrobenzoic acid carrying the nitro substituent at position 2.","@language":"en","provenance":{"prov:was… | Merged ChEBI/PubChem definitions into skos:definition |
| 241,335 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.389.648H","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['552-16-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_25620']; candidate_pubchem_cids=[11087, 5159892]; selected_pubchem_cids=[11087]; 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 |
| 252,396 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | rdkit_pre_consensus from 'C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]'; added: monoisotopic_mass |
| 256,375 | chebi_altlabels | altLabel | [] | [{"@value":"o-Carboxynitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribut… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 261,230 | consensus_match | altLabel | [{"@value":"o-Carboxynitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribut… | [{"@value":"o-Carboxynitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribut… | group_key=2-nitrobenzoicacid||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=552-16-9; added Common Chemistry CAS names as altLabel: Benzoic acid, 2-nitro-, Benzoic acid, <em>o</em>-nitro-, NSC 9576; object_uuid=fo-6ba2c9c4db685643 |
| 261,231 | consensus_match | cas_match_labels | — | {"552-16-9":"exactMatch"} | group_key=2-nitrobenzoicacid||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'552-16-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6ba2c9c4db685643: {'552-16-9': 'exactMatch'} |
| 277,589 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-Nitrobenzoic Acid' |
| 284,286 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | rdkit_post_consensus from 'O=C(O)c1ccccc1[N+](=O)[O-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,315 | strip_catalogue_altlabels | altLabel | [{"@value":"o-Carboxynitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribut… | [{"@value":"o-Carboxynitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribut… | Removed 1 catalogue altLabel value(s): 'NSC 9576' (registry code) |
| 379,590 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f519c46c-70b6-… | associations resolved on the elementary layer |
| 391,944 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO4"],… | typed the way the ontology types it |
| 400,201 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260821T1302361922970000/14978 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v0 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v1 |
| ef:activity/change/20260821T1302361922970000/14979 | name | ef:agent/bootstrap_labels | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v1 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v2 |
| ef:activity/change/20260821T1302361922970000/14980 | synonyms | ef:agent/bootstrap_labels | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v2 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v3 |
| ef:activity/change/20260821T1302361922970000/197112 | context | ef:agent/default_context_mapping | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v3 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v4 |
| ef:activity/change/20260821T1302361922970000/197113 | context_iri | ef:agent/default_context_mapping | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v4 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v5 |
| ef:activity/change/20260821T1302361922970000/218274 | unit_iri | ef:agent/unit_normalization | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v5 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v6 |
| ef:activity/change/20260821T1302361922970000/224547 | prefLabel | ef:agent/normalize_name_case | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v6 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v7 |
| ef:activity/change/20260821T1302361922970000/226967 | ec_numbers | ef:agent/ec_cross_check | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v7 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v8 |
| ef:activity/change/20260821T1302361922970000/241333 | properties | ef:agent/enrich_references | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v8 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v9 |
| ef:activity/change/20260821T1302361922970000/241334 | skos_definition | ef:agent/enrich_references | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v9 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v10 |
| ef:activity/change/20260821T1302361922970000/241335 | references | ef:agent/enrich_references | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v10 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v11 |
| ef:activity/change/20260821T1302361922970000/252396 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v11 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v12 |
| ef:activity/change/20260821T1302361922970000/256375 | altLabel | ef:agent/chebi_altlabels | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v12 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v13 |
| ef:activity/change/20260821T1302361922970000/261230 | altLabel | ef:agent/consensus_match | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v13 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v14 |
| ef:activity/change/20260821T1302361922970000/261231 | cas_match_labels | ef:agent/consensus_match | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v14 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v15 |
| ef:activity/change/20260821T1302361922970000/277589 | properties | ef:agent/opsin_iupac | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v15 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v16 |
| ef:activity/change/20260821T1302361922970000/284286 | properties | ef:agent/rdkit_post_consensus | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v16 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v17 |
| ef:activity/change/20260821T1302361922970000/290315 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v17 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v18 |
| ef:activity/change/20260821T1302361922970000/379590 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v18 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v19 |
| ef:activity/change/20260821T1302361922970000/391944 | properties | ef:agent/normalise_property_values | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v19 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v20 |
| ef:activity/change/20260821T1302361922970000/400201 | types | ef:agent/link_flows_to_their_substance | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v20 | ef:flow/f519c46c-70b6-4f71-9a18-3d80de2387d6/v21 |