Xylenesulphonic Acid
Everything that changed this flow. Back to the flow
e41e0960-88a9-42e0-a9ac-ddb832dbc09c
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 |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 3 catalogue altLabel value(s): 'Taycatox 100' (trade name), 'Taycatox 110' (trade name), 'XSA 90' (grade 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=xylenesulphonicacid||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'25321-41-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-296841b996534ca2: {'25321-41-9': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['25321-41-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[6938, 11868, 172623, 53400739]; selected_pubchem_cids=[172623, 53400739]; 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 |
|---|---|---|---|---|---|
| 16,404 | bootstrap_labels | prefLabel | — | [{"@value":"xylenesulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Bootstrapped prefLabel from legacy name field |
| 16,405 | bootstrap_labels | name | xylenesulphonic acid | — | Purged legacy name field to enforce prefLabel usage |
| 16,406 | bootstrap_labels | synonyms | ["organic","xylenesulphonicacid","kyselinaxylensulfonovã¡","spolaponxs"] | [] | Removed legacy synonyms field in favor of structured labels |
| 186,470 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 186,471 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 218,724 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,859 | normalize_name_case | prefLabel | [{"@value":"xylenesulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | [{"@value":"Xylenesulphonic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,608 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 242,609 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,610 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.071.885F","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['25321-41-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[6938, 11868, 172623, 53400739]; selected_pubchem_cids=[172623, 53400739]; 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 |
| 252,766 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | rdkit_pre_consensus from 'C.C.C1=CC=CC=C1.OS(=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 273,286 | consensus_match | altLabel | [] | [{"@value":"Benzenesulfonic acid, dimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | group_key=xylenesulphonicacid||dimension=Environmental > media=Ground > geography=Agricultural; cas=25321-41-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, dimethyl-, Dimethylbenzenesulfonic acid, Taycatox 100, Taycatox 110, XSA 90, Xylene-<em>ar</em>-sulfonic acid, Xylenesulfonic acid; object_uuid=fo-296841b996534ca2 |
| 273,287 | consensus_match | cas_match_labels | — | {"25321-41-9":"exactMatch"} | group_key=xylenesulphonicacid||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'25321-41-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-296841b996534ca2: {'25321-41-9': 'exactMatch'} |
| 284,691 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | rdkit_post_consensus from 'C.C.C1=CC=CC=C1.OS(=O)[O-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,086 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H10O3S",… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 290,581 | strip_catalogue_altlabels | altLabel | [{"@value":"Benzenesulfonic acid, dimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | [{"@value":"Benzenesulfonic acid, dimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | Removed 3 catalogue altLabel value(s): 'Taycatox 100' (trade name), 'Taycatox 110' (trade name), 'XSA 90' (grade code) |
| 374,262 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e41e0960-88a9-… | associations resolved on the elementary layer |
| 400,733 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1302361922970000/16404 | prefLabel | ef:agent/bootstrap_labels | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v0 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v1 |
| ef:activity/change/20260821T1302361922970000/16405 | name | ef:agent/bootstrap_labels | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v1 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v2 |
| ef:activity/change/20260821T1302361922970000/16406 | synonyms | ef:agent/bootstrap_labels | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v2 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v3 |
| ef:activity/change/20260821T1302361922970000/186470 | context | ef:agent/default_context_mapping | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v3 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v4 |
| ef:activity/change/20260821T1302361922970000/186471 | context_iri | ef:agent/default_context_mapping | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v4 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v5 |
| ef:activity/change/20260821T1302361922970000/218724 | unit_iri | ef:agent/unit_normalization | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v5 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v6 |
| ef:activity/change/20260821T1302361922970000/224859 | prefLabel | ef:agent/normalize_name_case | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v6 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v7 |
| ef:activity/change/20260821T1302361922970000/242608 | properties | ef:agent/enrich_references | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v7 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v8 |
| ef:activity/change/20260821T1302361922970000/242609 | skos_definition | ef:agent/enrich_references | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v8 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v9 |
| ef:activity/change/20260821T1302361922970000/242610 | references | ef:agent/enrich_references | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v9 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v10 |
| ef:activity/change/20260821T1302361922970000/252766 | properties | ef:agent/rdkit_pre_consensus | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v10 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v11 |
| ef:activity/change/20260821T1302361922970000/273286 | altLabel | ef:agent/consensus_match | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v11 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v12 |
| ef:activity/change/20260821T1302361922970000/273287 | cas_match_labels | ef:agent/consensus_match | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v12 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v13 |
| ef:activity/change/20260821T1302361922970000/284691 | properties | ef:agent/rdkit_post_consensus | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v13 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v14 |
| ef:activity/change/20260821T1302361922970000/287086 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v14 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v15 |
| ef:activity/change/20260821T1302361922970000/290581 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v15 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v16 |
| ef:activity/change/20260821T1302361922970000/374262 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v16 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v17 |
| ef:activity/change/20260821T1302361922970000/400733 | types | ef:agent/link_flows_to_their_substance | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v17 | ef:flow/e41e0960-88a9-42e0-a9ac-ddb832dbc09c/v18 |