Diisopropyl Paraoxon
Everything that changed this flow. Back to the flow
27f12d28-64f7-4a4b-8ab2-d38272f78e4b
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): 'BAY 61877' (grade code), 'NSC 132954' (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=diisopropylparaoxon||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3254-66-8': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-da84f7ab5a5f222b: {'3254-66-8': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['3254-66-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[76742]; selected_pubchem_cids=[76742]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,516 | bootstrap_labels | prefLabel | — | [{"@value":"diisopropyl paraoxon","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Bootstrapped prefLabel from legacy name field |
| 5,517 | bootstrap_labels | name | diisopropyl paraoxon | — | Purged legacy name field to enforce prefLabel usage |
| 5,518 | bootstrap_labels | synonyms | ["(4-nitrophenyl) dipropan-2-yl phosphate","AC1L2RKJ","BAY 61877","Diisopropyl p-nitrophenyl phosphate","Isopropyl para… | [] | Removed legacy synonyms field in favor of structured labels |
| 62,752 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 62,753 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 215,181 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,374 | normalize_name_case | prefLabel | [{"@value":"diisopropyl paraoxon","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | [{"@value":"Diisopropyl Paraoxon","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,483 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,484 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,485 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.699F","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['3254-66-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[76742]; selected_pubchem_cids=[76742]; 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 |
| 249,839 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | rdkit_pre_consensus from 'CC(C)OP(=O)(OC1=CC=C(C=C1)[N+](=O)[O-])OC(C)C'; added: molecular_mass, monoisotopic_mass |
| 266,016 | consensus_match | altLabel | [] | [{"@value":"(4-Nitrophenyl) dipropan-2-yl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | group_key=diisopropylparaoxon||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=3254-66-8; added Common Chemistry CAS names as altLabel: (4-Nitrophenyl) dipropan-2-yl phosphate, BAY 61877, Bis(1-methylethyl) 4-nitrophenyl phosphate, Diisopropyl <em>p</em>-nitrophenyl phosphate, Isopropyl paraoxon, Miopticol, Mioticol, NSC 132954, Phosphoric acid, bis(1-methylethyl) 4-nitrophenyl ester, Phosphoric acid, diisopropyl <em>p</em>-nitrophenyl ester, Propicol; object_uuid=fo-da84f7ab5a5f222b |
| 266,017 | consensus_match | cas_match_labels | — | {"3254-66-8":"exactMatch"} | group_key=diisopropylparaoxon||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3254-66-8': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-da84f7ab5a5f222b: {'3254-66-8': 'exactMatch'} |
| 274,978 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(4-Nitrophenyl) dipropan-2-yl phosphate' |
| 281,462 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | rdkit_post_consensus from 'CC(C)OP(=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,379 | strip_catalogue_altlabels | altLabel | [{"@value":"(4-Nitrophenyl) dipropan-2-yl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | [{"@value":"(4-Nitrophenyl) dipropan-2-yl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | Removed 2 catalogue altLabel value(s): 'BAY 61877' (grade code), 'NSC 132954' (registry code) |
| 312,394 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/27f12d28-64f7-… | associations resolved on the elementary layer |
| 389,287 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18NO6P… | typed the way the ontology types it |
| 396,368 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260822T0600486828500000/5516 | prefLabel | ef:agent/bootstrap_labels | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v0 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v1 |
| ef:activity/change/20260822T0600486828500000/5517 | name | ef:agent/bootstrap_labels | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v1 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v2 |
| ef:activity/change/20260822T0600486828500000/5518 | synonyms | ef:agent/bootstrap_labels | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v2 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v3 |
| ef:activity/change/20260822T0600486828500000/62752 | context | ef:agent/default_context_mapping | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v3 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v4 |
| ef:activity/change/20260822T0600486828500000/62753 | context_iri | ef:agent/default_context_mapping | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v4 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v5 |
| ef:activity/change/20260822T0600486828500000/215181 | unit_iri | ef:agent/unit_normalization | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v5 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v6 |
| ef:activity/change/20260822T0600486828500000/222374 | prefLabel | ef:agent/normalize_name_case | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v6 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v7 |
| ef:activity/change/20260822T0600486828500000/232483 | properties | ef:agent/enrich_references | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v7 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v8 |
| ef:activity/change/20260822T0600486828500000/232484 | skos_definition | ef:agent/enrich_references | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v8 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v9 |
| ef:activity/change/20260822T0600486828500000/232485 | references | ef:agent/enrich_references | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v9 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v10 |
| ef:activity/change/20260822T0600486828500000/249839 | properties | ef:agent/rdkit_pre_consensus | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v10 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v11 |
| ef:activity/change/20260822T0600486828500000/266016 | altLabel | ef:agent/consensus_match | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v11 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v12 |
| ef:activity/change/20260822T0600486828500000/266017 | cas_match_labels | ef:agent/consensus_match | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v12 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v13 |
| ef:activity/change/20260822T0600486828500000/274978 | properties | ef:agent/opsin_iupac | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v13 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v14 |
| ef:activity/change/20260822T0600486828500000/281462 | properties | ef:agent/rdkit_post_consensus | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v14 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v15 |
| ef:activity/change/20260822T0600486828500000/288379 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v15 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v16 |
| ef:activity/change/20260822T0600486828500000/312394 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v16 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v17 |
| ef:activity/change/20260822T0600486828500000/389287 | properties | ef:agent/normalise_property_values | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v17 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v18 |
| ef:activity/change/20260822T0600486828500000/396368 | types | ef:agent/link_flows_to_their_substance | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v18 | ef:flow/27f12d28-64f7-4a4b-8ab2-d38272f78e4b/v19 |