4-nitrobenzamide
Everything that changed this flow. Back to the flow
7aa56bcc-cec5-43cc-95f7-f261445f6a10
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 2902' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=4-nitrobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'619-80-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-71b5a935ad64f1c2: {'619-80-7': '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 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 |
| 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=['619-80-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[12091, 20087578]; selected_pubchem_cids=[12091]; 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 |
|---|---|---|---|---|---|
| 11,136 | bootstrap_labels | prefLabel | — | [{"@value":"4-nitrobenzamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 11,137 | bootstrap_labels | name | 4-nitrobenzamide | — | Purged legacy name field to enforce prefLabel usage |
| 11,138 | bootstrap_labels | synonyms | ["AC1L1YTR","AC1Q4ZBD","AKOS003261392","Benzamide, 4-nitro-","Benzamide, p-nitro-","N0323","NCI60_002383","ST50406673",… | [] | Removed legacy synonyms field in favor of structured labels |
| 122,660 | 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 |
| 122,661 | 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 |
| 217,031 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 237,776 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 237,777 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,778 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J62.020C","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['619-80-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[12091, 20087578]; selected_pubchem_cids=[12091]; 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 |
| 251,361 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | rdkit_pre_consensus from 'C1=CC(=CC=C1C(=O)N)[N+](=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 262,885 | consensus_match | altLabel | [] | [{"@value":"<em>p</em>-Nitrobenzamide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttr… | group_key=4-nitrobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=619-80-7; added Common Chemistry CAS names as altLabel: <em>p</em>-Nitrobenzamide, Benzamide, 4-nitro-, Benzamide, <em>p</em>-nitro-, NSC 2902; object_uuid=fo-71b5a935ad64f1c2 |
| 262,886 | consensus_match | cas_match_labels | — | {"619-80-7":"exactMatch"} | group_key=4-nitrobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'619-80-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-71b5a935ad64f1c2: {'619-80-7': 'exactMatch'} |
| 276,541 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-nitrobenzamide' |
| 283,156 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | rdkit_post_consensus from 'NC(=O)c1ccc([N+](=O)[O-])cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,560 | strip_catalogue_altlabels | altLabel | [{"@value":"<em>p</em>-Nitrobenzamide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttr… | [{"@value":"p-Nitrobenzamide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo"… | Removed 1 catalogue altLabel value(s): 'NSC 2902' (registry code) |
| 342,328 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7aa56bcc-cec5-… | associations resolved on the elementary layer |
| 390,898 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6N2O3"]… | typed the way the ontology types it |
| 398,706 | 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/20260821T1302361922970000/11136 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v0 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v1 |
| ef:activity/change/20260821T1302361922970000/11137 | name | ef:agent/bootstrap_labels | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v1 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v2 |
| ef:activity/change/20260821T1302361922970000/11138 | synonyms | ef:agent/bootstrap_labels | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v2 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v3 |
| ef:activity/change/20260821T1302361922970000/122660 | context | ef:agent/default_context_mapping | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v3 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v4 |
| ef:activity/change/20260821T1302361922970000/122661 | context_iri | ef:agent/default_context_mapping | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v4 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v5 |
| ef:activity/change/20260821T1302361922970000/217031 | unit_iri | ef:agent/unit_normalization | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v5 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v6 |
| ef:activity/change/20260821T1302361922970000/237776 | properties | ef:agent/enrich_references | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v6 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v7 |
| ef:activity/change/20260821T1302361922970000/237777 | skos_definition | ef:agent/enrich_references | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v7 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v8 |
| ef:activity/change/20260821T1302361922970000/237778 | references | ef:agent/enrich_references | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v8 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v9 |
| ef:activity/change/20260821T1302361922970000/251361 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v9 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v10 |
| ef:activity/change/20260821T1302361922970000/262885 | altLabel | ef:agent/consensus_match | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v10 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v11 |
| ef:activity/change/20260821T1302361922970000/262886 | cas_match_labels | ef:agent/consensus_match | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v11 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v12 |
| ef:activity/change/20260821T1302361922970000/276541 | properties | ef:agent/opsin_iupac | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v12 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v13 |
| ef:activity/change/20260821T1302361922970000/283156 | properties | ef:agent/rdkit_post_consensus | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v13 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v14 |
| ef:activity/change/20260821T1302361922970000/289560 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v14 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v15 |
| ef:activity/change/20260821T1302361922970000/342328 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v15 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v16 |
| ef:activity/change/20260821T1302361922970000/390898 | properties | ef:agent/normalise_property_values | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v16 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v17 |
| ef:activity/change/20260821T1302361922970000/398706 | types | ef:agent/link_flows_to_their_substance | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v17 | ef:flow/7aa56bcc-cec5-43cc-95f7-f261445f6a10/v18 |