Proquazone
Everything that changed this flow. Back to the flow
d27b64fb-eb83-42c1-900c-0dfc0152f498
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=proquazone||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'22760-18-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0102b6ed1558abaa: {'22760-18-5': '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 lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['22760-18-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_135151']; candidate_pubchem_cids=[31508]; selected_pubchem_cids=[31508]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 15,992 | bootstrap_labels | prefLabel | — | [{"@value":"proquazone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | Bootstrapped prefLabel from legacy name field |
| 15,993 | bootstrap_labels | name | proquazone | — | Purged legacy name field to enforce prefLabel usage |
| 15,994 | bootstrap_labels | synonyms | ["organic","proquazone"] | [] | Removed legacy synonyms field in favor of structured labels |
| 174,466 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 174,467 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 218,594 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,769 | normalize_name_case | prefLabel | [{"@value":"proquazone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | [{"@value":"Proquazone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,240 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 242,241 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,242 | enrich_references | references | [] | [{"@id":"drugcentral:2311","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['22760-18-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_135151']; candidate_pubchem_cids=[31508]; selected_pubchem_cids=[31508]; 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 |
| 252,659 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | rdkit_pre_consensus from 'CC1=CC2=C(C=C1)C(=NC(=O)N2C(C)C)C3=CC=CC=C3'; added: monoisotopic_mass |
| 256,505 | chebi_altlabels | altLabel | [] | [{"@value":"anthrex","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 271,149 | consensus_match | altLabel | [{"@value":"anthrex","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"anthrex","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | group_key=proquazone||dimension=Environmental > media=Water > water_body=Surface water; cas=22760-18-5; added Common Chemistry CAS names as altLabel: 1-Isopropyl-4-phenyl-7-methyl-2(1<em>H</em>)-quinazolinone, 1-Isopropyl-7-methyl-4-phenylquinazolin-2(1<em>H</em>)-one, 2(1<em>H</em>)-Quinazolinone, 1-isopropyl-7-methyl-4-phenyl-, 2(1<em>H</em>)-Quinazolinone, 7-methyl-1-(1-methylethyl)-4-phenyl-, 7-Methyl-1-(1-methylethyl)-4-phenyl-2(1<em>H</em>)-quinazolinone, RU 43-715, SAN 43-715, SaH 43-715, Sandoz 43-715; object_uuid=fo-0102b6ed1558abaa |
| 271,150 | consensus_match | cas_match_labels | — | {"22760-18-5":"exactMatch"} | group_key=proquazone||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'22760-18-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0102b6ed1558abaa: {'22760-18-5': 'exactMatch'} |
| 277,866 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-Isopropyl-4-phenyl-7-methyl-2(1H)-quinazolinone' |
| 284,575 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | rdkit_post_consensus from 'Cc1ccc2c(-c3ccccc3)nc(=O)n(C(C)C)c2c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,853 | dedupe_altlabels | altLabel | [{"@value":"anthrex","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"anthrex","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Deduplicated altLabel values and removed entries matching prefLabel |
| 368,257 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d27b64fb-eb83-… | associations resolved on the elementary layer |
| 392,222 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H18N2O"… | typed the way the ontology types it |
| 400,578 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T1554374006150000/15992 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v0 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v1 |
| ef:activity/change/20260821T1554374006150000/15993 | name | ef:agent/bootstrap_labels | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v1 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v2 |
| ef:activity/change/20260821T1554374006150000/15994 | synonyms | ef:agent/bootstrap_labels | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v2 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v3 |
| ef:activity/change/20260821T1554374006150000/174466 | context | ef:agent/default_context_mapping | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v3 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v4 |
| ef:activity/change/20260821T1554374006150000/174467 | context_iri | ef:agent/default_context_mapping | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v4 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v5 |
| ef:activity/change/20260821T1554374006150000/218594 | unit_iri | ef:agent/unit_normalization | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v5 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v6 |
| ef:activity/change/20260821T1554374006150000/224769 | prefLabel | ef:agent/normalize_name_case | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v6 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v7 |
| ef:activity/change/20260821T1554374006150000/242240 | properties | ef:agent/enrich_references | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v7 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v8 |
| ef:activity/change/20260821T1554374006150000/242241 | skos_definition | ef:agent/enrich_references | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v8 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v9 |
| ef:activity/change/20260821T1554374006150000/242242 | references | ef:agent/enrich_references | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v9 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v10 |
| ef:activity/change/20260821T1554374006150000/252659 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v10 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v11 |
| ef:activity/change/20260821T1554374006150000/256505 | altLabel | ef:agent/chebi_altlabels | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v11 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v12 |
| ef:activity/change/20260821T1554374006150000/271149 | altLabel | ef:agent/consensus_match | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v12 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v13 |
| ef:activity/change/20260821T1554374006150000/271150 | cas_match_labels | ef:agent/consensus_match | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v13 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v14 |
| ef:activity/change/20260821T1554374006150000/277866 | properties | ef:agent/opsin_iupac | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v14 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v15 |
| ef:activity/change/20260821T1554374006150000/284575 | properties | ef:agent/rdkit_post_consensus | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v15 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v16 |
| ef:activity/change/20260821T1554374006150000/292853 | altLabel | ef:agent/dedupe_altlabels | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v16 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v17 |
| ef:activity/change/20260821T1554374006150000/368257 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v17 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v18 |
| ef:activity/change/20260821T1554374006150000/392222 | properties | ef:agent/normalise_property_values | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v18 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v19 |
| ef:activity/change/20260821T1554374006150000/400578 | types | ef:agent/link_flows_to_their_substance | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v19 | ef:flow/d27b64fb-eb83-42c1-900c-0dfc0152f498/v20 |