Mixture Of Octachloro, Monomethoxy-heptachloro And Bismethoxy-hexachloro Derivatives Of 3,3'-(1,4-phenylenedinitrilo)bis[2,3-dihydro-1h-isoindol-1-one]
Everything that changed this flow. Back to the flow
0dd24f52-55bd-45d0-9218-37df9de233e7
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=mixtureofoctachloro,monomethoxy-heptachloroandbismethoxy-hexachloroderivativesof3,3'-(1,4-phenylenedinitrilo)bis[2,3-dihydro-1h-isoindol-1-one]||dimension=Environmental > media=Water > water_body=Ocean; cas=106276-80-6; added Common Chemistry CAS names as altLabel: Benzoic acid, 2,3,4,5-tetrachloro-6-cyano-, methyl ester, reaction products with <em>p</em>-phenylenediamine and sodium methoxide; object_uuid=fo-393f513a04bd4795 |
| cas_match_labels | 1 | consensus_match | group_key=mixtureofoctachloro,monomethoxy-heptachloroandbismethoxy-hexachloroderivativesof3,3'-(1,4-phenylenedinitrilo)bis[2,3-dihydro-1h-isoindol-1-one]||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'106276-80-6': []}; assigned CAS labels from group consensus; object_uuid=fo-393f513a04bd4795: {'106276-80-6': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['106276-80-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[23674311, 135481899]; selected_pubchem_cids=[23674311, 135481899]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 11,833 | bootstrap_labels | prefLabel | — | [{"@value":"mixture of octachloro, monomethoxy-heptachloro and bismethoxy-hexachloro derivatives of 3,3'-(1,4-phenylene… | Bootstrapped prefLabel from legacy name field |
| 11,834 | bootstrap_labels | name | mixture of octachloro, monomethoxy-heptachloro and bismethoxy-hexachloro derivatives of 3,3'-(1,4-phenylenedinitrilo)bi… | — | Purged legacy name field to enforce prefLabel usage |
| 11,835 | bootstrap_labels | synonyms | ["organic","benzoicacid,2,3,4,5-tetrachloro-6-cyano-,methylester,reactionproductswithp-phenylenediamineandsodiummethoxi… | [] | Removed legacy synonyms field in favor of structured labels |
| 45,564 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 45,565 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 217,262 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,837 | normalize_name_case | prefLabel | [{"@value":"mixture of octachloro, monomethoxy-heptachloro and bismethoxy-hexachloro derivatives of 3,3'-(1,4-phenylene… | [{"@value":"Mixture Of Octachloro, Monomethoxy-heptachloro And Bismethoxy-hexachloro Derivatives Of 3,3'-(1,4-phenylene… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 238,439 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 238,440 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,441 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J62.958H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['106276-80-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[23674311, 135481899]; selected_pubchem_cids=[23674311, 135481899]; 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 |
| 251,551 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | rdkit_pre_consensus from 'C1=CC(=CC=C1N=C2C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)N2)N=C4C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)N4'; added: molecular_mass, monoisotopic_mass |
| 269,024 | consensus_match | altLabel | [] | [{"@value":"Benzoic acid, 2,3,4,5-tetrachloro-6-cyano-, methyl ester, reaction products with <em>p</em>-phenylenediamin… | group_key=mixtureofoctachloro,monomethoxy-heptachloroandbismethoxy-hexachloroderivativesof3,3'-(1,4-phenylenedinitrilo)bis[2,3-dihydro-1h-isoindol-1-one]||dimension=Environmental > media=Water > water_body=Ocean; cas=106276-80-6; added Common Chemistry CAS names as altLabel: Benzoic acid, 2,3,4,5-tetrachloro-6-cyano-, methyl ester, reaction products with <em>p</em>-phenylenediamine and sodium methoxide; object_uuid=fo-393f513a04bd4795 |
| 269,025 | consensus_match | cas_match_labels | — | {"106276-80-6":"exactMatch"} | group_key=mixtureofoctachloro,monomethoxy-heptachloroandbismethoxy-hexachloroderivativesof3,3'-(1,4-phenylenedinitrilo)bis[2,3-dihydro-1h-isoindol-1-one]||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'106276-80-6': []}; assigned CAS labels from group consensus; object_uuid=fo-393f513a04bd4795: {'106276-80-6': 'exactMatch'} |
| 283,368 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | rdkit_post_consensus from 'C1=CC(=CC=C1N=C2C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)N2)N=C4C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)N4'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,978 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H14Cl4N… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 303,808 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0dd24f52-55bd-… | associations resolved on the elementary layer |
| 398,976 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260822T0600486828500000/11833 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v0 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v1 |
| ef:activity/change/20260822T0600486828500000/11834 | name | ef:agent/bootstrap_labels | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v1 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v2 |
| ef:activity/change/20260822T0600486828500000/11835 | synonyms | ef:agent/bootstrap_labels | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v2 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v3 |
| ef:activity/change/20260822T0600486828500000/45564 | context | ef:agent/default_context_mapping | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v3 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v4 |
| ef:activity/change/20260822T0600486828500000/45565 | context_iri | ef:agent/default_context_mapping | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v4 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v5 |
| ef:activity/change/20260822T0600486828500000/217262 | unit_iri | ef:agent/unit_normalization | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v5 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v6 |
| ef:activity/change/20260822T0600486828500000/223837 | prefLabel | ef:agent/normalize_name_case | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v6 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v7 |
| ef:activity/change/20260822T0600486828500000/238439 | properties | ef:agent/enrich_references | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v7 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v8 |
| ef:activity/change/20260822T0600486828500000/238440 | skos_definition | ef:agent/enrich_references | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v8 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v9 |
| ef:activity/change/20260822T0600486828500000/238441 | references | ef:agent/enrich_references | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v9 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v10 |
| ef:activity/change/20260822T0600486828500000/251551 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v10 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v11 |
| ef:activity/change/20260822T0600486828500000/269024 | altLabel | ef:agent/consensus_match | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v11 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v12 |
| ef:activity/change/20260822T0600486828500000/269025 | cas_match_labels | ef:agent/consensus_match | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v12 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v13 |
| ef:activity/change/20260822T0600486828500000/283368 | properties | ef:agent/rdkit_post_consensus | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v13 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v14 |
| ef:activity/change/20260822T0600486828500000/286978 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v14 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v15 |
| ef:activity/change/20260822T0600486828500000/303808 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v15 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v16 |
| ef:activity/change/20260822T0600486828500000/398976 | types | ef:agent/link_flows_to_their_substance | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v16 | ef:flow/0dd24f52-55bd-45d0-9218-37df9de233e7/v17 |