Triaziquone
Everything that changed this flow. Back to the flow
fe0acd60-3ddc-11dd-a3ae-0050c2490048
By field
14 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, strip_catalogue_altlabels | Removed 4 catalogue altLabel value(s): 'A 163' (grade code), 'BAY 3231' (grade code), 'NSC-29215' (registry code), 'Riker 601' (trade name) |
| 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=triaziquone||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'68-76-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-59a31d07a367bf60: {'68-76-8': '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 soil > Emissions to non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 200-692-6 from CAS 68-76-8 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['68-76-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_27090']; candidate_pubchem_cids=[6235]; selected_pubchem_cids=[6235]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 22,676 | bootstrap_labels | prefLabel | — | [{"@value":"triaziquone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | Bootstrapped prefLabel from legacy name field |
| 22,677 | bootstrap_labels | name | triaziquone | — | Purged legacy name field to enforce prefLabel usage |
| 22,678 | bootstrap_labels | synonyms | ["1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2, 4-triyl)trisaziridine","1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triy… | [] | Removed legacy synonyms field in favor of structured labels |
| 205,098 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 205,099 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 220,524 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,185 | normalize_name_case | prefLabel | [{"@value":"triaziquone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | [{"@value":"Triaziquone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,073 | ec_cross_check | ec_numbers | [] | ["200-692-6"] | Resolved from EC-inventory: 200-692-6 from CAS 68-76-8 |
| 247,588 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 247,589 | enrich_references | skos_definition | — | [{"@value":"A member of the class of 1,4-benzoquinones that is 1,4-benzoquinone in which three of the ring hydrogens ar… | Merged ChEBI/PubChem definitions into skos:definition |
| 247,590 | enrich_references | references | [] | [{"@id":"drugcentral:4372","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['68-76-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_27090']; candidate_pubchem_cids=[6235]; selected_pubchem_cids=[6235]; 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 |
| 254,205 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | rdkit_pre_consensus from 'C1CN1C2=CC(=O)C(=C(C2=O)N3CC3)N4CC4'; added: monoisotopic_mass |
| 257,239 | chebi_altlabels | altLabel | [] | [{"@value":"1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine","@language":"en","source":{"prov:wasGener… | Added 23 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 272,764 | consensus_match | altLabel | [{"@value":"1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine","@language":"en","source":{"prov:wasGener… | [{"@value":"1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine","@language":"en","source":{"prov:wasGener… | group_key=triaziquone||dimension=Environmental > media=Ground > geography=Agricultural; cas=68-76-8; added Common Chemistry CAS names as altLabel: 10257RP, 2,3,5-Triethyleneimino-<em>p</em>-benzoquinone, 2,3,5-Tris(1-aziridinyl)-1,4-benzoquinone, 2,3,5-Tris(aziridinyl)-1,4-benzoquinone, 2,5-Cyclohexadiene-1,4-dione, 2,3,5-tris(1-aziridinyl)-, <em>p</em>-Benzoquinone, 2,3,5-tris(1-aziridinyl)-, <em>p</em>-Benzoquinone, tris(1-aziridinyl)-, A 163, BAY 3231, MeSH ID: D014228, NSC-29215, Oncoredox, Oncovedex, Prenimon, Riker 601, TEIB, Trenimon, Treninon, Triaziquinone, Triaziquinonum, Triaziquon, Triethyleneiminobenzoquinone, Triethyleniminobenzoquinone, Trisethyleneiminoquinone; object_uuid=fo-59a31d07a367bf60 |
| 272,765 | consensus_match | cas_match_labels | — | {"68-76-8":"exactMatch"} | group_key=triaziquone||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'68-76-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-59a31d07a367bf60: {'68-76-8': 'exactMatch'} |
| 279,422 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine' |
| 286,298 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | rdkit_post_consensus from 'O=C1C=C(N2CC2)C(=O)C(N2CC2)=C1N1CC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,652 | strip_catalogue_altlabels | altLabel | [{"@value":"1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine","@language":"en","source":{"prov:wasGener… | [{"@value":"1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine","@language":"en","source":{"prov:wasGener… | Removed 4 catalogue altLabel value(s): 'A 163' (grade code), 'BAY 3231' (grade code), 'NSC-29215' (registry code), 'Riker 601' (trade name) |
| 383,583 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fe0acd60-3ddc-… | associations resolved on the elementary layer |
| 393,815 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H13N3O2… | typed the way the ontology types it |
| 403,005 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260821T1554374006150000/22676 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v0 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v1 |
| ef:activity/change/20260821T1554374006150000/22677 | name | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v1 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v2 |
| ef:activity/change/20260821T1554374006150000/22678 | synonyms | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v2 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v3 |
| ef:activity/change/20260821T1554374006150000/205098 | context | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v3 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v4 |
| ef:activity/change/20260821T1554374006150000/205099 | context_iri | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v4 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v5 |
| ef:activity/change/20260821T1554374006150000/220524 | unit_iri | ef:agent/unit_normalization | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v5 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v6 |
| ef:activity/change/20260821T1554374006150000/226185 | prefLabel | ef:agent/normalize_name_case | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v6 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v7 |
| ef:activity/change/20260821T1554374006150000/227073 | ec_numbers | ef:agent/ec_cross_check | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v7 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v8 |
| ef:activity/change/20260821T1554374006150000/247588 | properties | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v8 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v9 |
| ef:activity/change/20260821T1554374006150000/247589 | skos_definition | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v9 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v10 |
| ef:activity/change/20260821T1554374006150000/247590 | references | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v10 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v11 |
| ef:activity/change/20260821T1554374006150000/254205 | properties | ef:agent/rdkit_pre_consensus | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v11 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v12 |
| ef:activity/change/20260821T1554374006150000/257239 | altLabel | ef:agent/chebi_altlabels | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v12 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v13 |
| ef:activity/change/20260821T1554374006150000/272764 | altLabel | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v13 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v14 |
| ef:activity/change/20260821T1554374006150000/272765 | cas_match_labels | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v14 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v15 |
| ef:activity/change/20260821T1554374006150000/279422 | properties | ef:agent/opsin_iupac | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v15 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v16 |
| ef:activity/change/20260821T1554374006150000/286298 | properties | ef:agent/rdkit_post_consensus | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v16 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v17 |
| ef:activity/change/20260821T1554374006150000/291652 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v17 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v18 |
| ef:activity/change/20260821T1554374006150000/383583 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v18 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v19 |
| ef:activity/change/20260821T1554374006150000/393815 | properties | ef:agent/normalise_property_values | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v19 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v20 |
| ef:activity/change/20260821T1554374006150000/403005 | types | ef:agent/link_flows_to_their_substance | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v20 | ef:flow/fe0acd60-3ddc-11dd-a3ae-0050c2490048/v21 |