2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide
Everything that changed this flow. Back to the flow
7b39299c-02aa-438a-927c-21fddd2d78f6
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): 'C.I. 11738' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'13515-40-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7624f25e5f7fcbd0: {'13515-40-7': '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 water > Emissions to fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 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=['13515-40-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[61637, 76962889]; selected_pubchem_cids=[61637]; 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 |
|---|---|---|---|---|---|
| 1,892 | bootstrap_labels | prefLabel | — | [{"@value":"2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide","@language":"en","source":{"prov:… | Bootstrapped prefLabel from legacy name field |
| 1,893 | bootstrap_labels | name | 2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide | — | Purged legacy name field to enforce prefLabel usage |
| 1,894 | bootstrap_labels | synonyms | ["organic","2-[(4-chloro-2-nitrophenyl)azo]-n-(2-methoxyphenyl)-3-oxobutyramide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 122,934 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 122,935 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 213,969 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 229,001 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,002 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,003 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.091J","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['13515-40-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[61637, 76962889]; selected_pubchem_cids=[61637]; 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 |
| 248,841 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | rdkit_pre_consensus from 'CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 260,413 | consensus_match | altLabel | [] | [{"@value":"2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-<em>N</em>-(2-methoxyphenyl)-3-oxobutanamide","@language":"en","sour… | group_key=2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide||dimension=Environmental > media=Air > strata=Unknown; cas=13515-40-7; added Common Chemistry CAS names as altLabel: 2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-<em>N</em>-(2-methoxyphenyl)-3-oxobutanamide, <em>o</em>-Acetoacetanisidide, 2-[(4-chloro-2-nitrophenyl)azo]-, Arylide Yellow GX, Butanamide, 2-[(4-chloro-2-nitrophenyl)azo]-<em>N</em>-(2-methoxyphenyl)-3-oxo-, Butanamide, 2-[2-(4-chloro-2-nitrophenyl)diazenyl]-<em>N</em>-(2-methoxyphenyl)-3-oxo-, C.I. 11738, C.I. Pigment Yellow 73, Hansa Brilliant Yellow 4GX, Monolite Fast Yellow EYA, Pigment Yellow 73, Symuler Fast Yellow 4117; object_uuid=fo-7624f25e5f7fcbd0 |
| 260,414 | consensus_match | cas_match_labels | — | {"13515-40-7":"exactMatch"} | group_key=2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'13515-40-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7624f25e5f7fcbd0: {'13515-40-7': 'exactMatch'} |
| 273,963 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide' |
| 280,363 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | rdkit_post_consensus from 'COc1ccccc1NC(=O)C(N=Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,632 | strip_catalogue_altlabels | altLabel | [{"@value":"2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-<em>N</em>-(2-methoxyphenyl)-3-oxobutanamide","@language":"en","sour… | [{"@value":"2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide","@language":"en","source":{"pro… | Removed 1 catalogue altLabel value(s): 'C.I. 11738' (registry code) |
| 342,465 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7b39299c-02aa-… | associations resolved on the elementary layer |
| 388,253 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClN4… | typed the way the ontology types it |
| 394,906 | 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/20260821T1302361922970000/1892 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v0 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v1 |
| ef:activity/change/20260821T1302361922970000/1893 | name | ef:agent/bootstrap_labels | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v1 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v2 |
| ef:activity/change/20260821T1302361922970000/1894 | synonyms | ef:agent/bootstrap_labels | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v2 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v3 |
| ef:activity/change/20260821T1302361922970000/122934 | context | ef:agent/default_context_mapping | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v3 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v4 |
| ef:activity/change/20260821T1302361922970000/122935 | context_iri | ef:agent/default_context_mapping | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v4 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v5 |
| ef:activity/change/20260821T1302361922970000/213969 | unit_iri | ef:agent/unit_normalization | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v5 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v6 |
| ef:activity/change/20260821T1302361922970000/229001 | properties | ef:agent/enrich_references | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v6 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v7 |
| ef:activity/change/20260821T1302361922970000/229002 | skos_definition | ef:agent/enrich_references | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v7 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v8 |
| ef:activity/change/20260821T1302361922970000/229003 | references | ef:agent/enrich_references | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v8 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v9 |
| ef:activity/change/20260821T1302361922970000/248841 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v9 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v10 |
| ef:activity/change/20260821T1302361922970000/260413 | altLabel | ef:agent/consensus_match | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v10 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v11 |
| ef:activity/change/20260821T1302361922970000/260414 | cas_match_labels | ef:agent/consensus_match | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v11 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v12 |
| ef:activity/change/20260821T1302361922970000/273963 | properties | ef:agent/opsin_iupac | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v12 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v13 |
| ef:activity/change/20260821T1302361922970000/280363 | properties | ef:agent/rdkit_post_consensus | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v13 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v14 |
| ef:activity/change/20260821T1302361922970000/287632 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v14 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v15 |
| ef:activity/change/20260821T1302361922970000/342465 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v15 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v16 |
| ef:activity/change/20260821T1302361922970000/388253 | properties | ef:agent/normalise_property_values | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v16 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v17 |
| ef:activity/change/20260821T1302361922970000/394906 | types | ef:agent/link_flows_to_their_substance | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v17 | ef:flow/7b39299c-02aa-438a-927c-21fddd2d78f6/v18 |