3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one
Everything that changed this flow. Back to the flow
4a5cac09-ea5d-4f8c-9a93-6717f3316270
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 2 catalogue altLabel value(s): 'C.I. 12915' (registry code), 'PO 67' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'74336-59-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c6612a16e57eabf3: {'74336-59-7': '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 air, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 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=['74336-59-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[166442]; selected_pubchem_cids=[166442]; 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 |
|---|---|---|---|---|---|
| 10,720 | bootstrap_labels | prefLabel | — | [{"@value":"3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one","@language":"en","source"… | Bootstrapped prefLabel from legacy name field |
| 10,721 | bootstrap_labels | name | 3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one | — | Purged legacy name field to enforce prefLabel usage |
| 10,722 | bootstrap_labels | synonyms | ["organic","3-[(4-chloro-2-nitrophenyl)azo]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one","c.i.12915","c.i.pigmentorange… | [] | Removed legacy synonyms field in favor of structured labels |
| 85,370 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 85,371 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 216,893 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 237,383 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 237,384 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,385 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J318.954F","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['74336-59-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[166442]; selected_pubchem_cids=[166442]; 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 |
| 251,244 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | rdkit_pre_consensus from 'CC1=C(C2=NC3=CC=CC=C3C(=O)N2N1)N=NC4=C(C=C(C=C4)Cl)[N+](=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 261,852 | consensus_match | altLabel | [] | [{"@value":"3-[2-(4-Chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-<em>b</em>]quinazolin-9(1<em>H</em>)-one","@lan… | group_key=3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one||dimension=Environmental > media=Water > water_body=Long-term; cas=74336-59-7; added Common Chemistry CAS names as altLabel: 3-[2-(4-Chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-<em>b</em>]quinazolin-9(1<em>H</em>)-one, C.I. 12915, C.I. Pigment Orange 67, PO 67, Paliotol Orange L 2930HD, Pigment Orange 67, Pyrazolo[5,1-<em>b</em>]quinazolin-9(1<em>H</em>)-one, 3-[(4-chloro-2-nitrophenyl)azo]-2-methyl-, Pyrazolo[5,1-<em>b</em>]quinazolin-9(1<em>H</em>)-one, 3-[2-(4-chloro-2-nitrophenyl)diazenyl]-2-methyl-; object_uuid=fo-c6612a16e57eabf3 |
| 261,853 | consensus_match | cas_match_labels | — | {"74336-59-7":"exactMatch"} | group_key=3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'74336-59-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c6612a16e57eabf3: {'74336-59-7': 'exactMatch'} |
| 276,429 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-[(4-chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1h)-one' |
| 283,032 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | rdkit_post_consensus from 'Cc1[nH]n2c(=O)c3ccccc3nc2c1N=Nc1ccc(Cl)cc1[N+](=O)[O-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,480 | strip_catalogue_altlabels | altLabel | [{"@value":"3-[2-(4-Chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-<em>b</em>]quinazolin-9(1<em>H</em>)-one","@lan… | [{"@value":"3-[2-(4-Chloro-2-nitrophenyl)diazenyl]-2-methylpyrazolo[5,1-b]quinazolin-9(1H)-one","@language":"en","sourc… | Removed 2 catalogue altLabel value(s): 'C.I. 12915' (registry code), 'PO 67' (grade code) |
| 323,700 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4a5cac09-ea5d-… | associations resolved on the elementary layer |
| 390,782 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H11ClN6… | typed the way the ontology types it |
| 398,548 | 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/20260821T1302361922970000/10720 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v0 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v1 |
| ef:activity/change/20260821T1302361922970000/10721 | name | ef:agent/bootstrap_labels | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v1 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v2 |
| ef:activity/change/20260821T1302361922970000/10722 | synonyms | ef:agent/bootstrap_labels | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v2 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v3 |
| ef:activity/change/20260821T1302361922970000/85370 | context | ef:agent/default_context_mapping | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v3 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v4 |
| ef:activity/change/20260821T1302361922970000/85371 | context_iri | ef:agent/default_context_mapping | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v4 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v5 |
| ef:activity/change/20260821T1302361922970000/216893 | unit_iri | ef:agent/unit_normalization | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v5 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v6 |
| ef:activity/change/20260821T1302361922970000/237383 | properties | ef:agent/enrich_references | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v6 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v7 |
| ef:activity/change/20260821T1302361922970000/237384 | skos_definition | ef:agent/enrich_references | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v7 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v8 |
| ef:activity/change/20260821T1302361922970000/237385 | references | ef:agent/enrich_references | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v8 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v9 |
| ef:activity/change/20260821T1302361922970000/251244 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v9 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v10 |
| ef:activity/change/20260821T1302361922970000/261852 | altLabel | ef:agent/consensus_match | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v10 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v11 |
| ef:activity/change/20260821T1302361922970000/261853 | cas_match_labels | ef:agent/consensus_match | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v11 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v12 |
| ef:activity/change/20260821T1302361922970000/276429 | properties | ef:agent/opsin_iupac | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v12 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v13 |
| ef:activity/change/20260821T1302361922970000/283032 | properties | ef:agent/rdkit_post_consensus | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v13 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v14 |
| ef:activity/change/20260821T1302361922970000/289480 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v14 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v15 |
| ef:activity/change/20260821T1302361922970000/323700 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v15 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v16 |
| ef:activity/change/20260821T1302361922970000/390782 | properties | ef:agent/normalise_property_values | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v16 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v17 |
| ef:activity/change/20260821T1302361922970000/398548 | types | ef:agent/link_flows_to_their_substance | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v17 | ef:flow/4a5cac09-ea5d-4f8c-9a93-6717f3316270/v18 |