Sodium Tridecylbenzenesulphonate
Everything that changed this flow. Back to the flow
bc1be29e-d2b0-44d3-a80b-8f467e135fd4
By field
14 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 3 candidate structures, so no one mass describes it |
| altLabel | 2 | 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=sodiumtridecylbenzenesulphonate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory']; cas_sources={'26248-24-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-6f142d2bbb0d97a5: {'26248-24-8': '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 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 |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 247-536-3 from CAS 26248-24-8 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['26248-24-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[23662540, 23670593, 23699607, 57376402]; selected_pubchem_cids=[23670593, 23699607, 57376402]; 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 |
|---|---|---|---|---|---|
| 10,976 | bootstrap_labels | prefLabel | — | [{"@value":"sodium tridecylbenzenesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | Bootstrapped prefLabel from legacy name field |
| 10,977 | bootstrap_labels | name | sodium tridecylbenzenesulphonate | — | Purged legacy name field to enforce prefLabel usage |
| 10,978 | bootstrap_labels | synonyms | ["Benzenesulfonic acid, tridecyl-, sodium salt","Benzenesulfonic acid, tridecyl-, sodium salt (1:1)","Conoco C 650","SO… | [] | Removed legacy synonyms field in favor of structured labels |
| 161,340 | 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 |
| 161,341 | 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 |
| 216,979 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,654 | normalize_name_case | prefLabel | [{"@value":"sodium tridecylbenzenesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | [{"@value":"Sodium Tridecylbenzenesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 226,927 | ec_cross_check | ec_numbers | [] | ["247-536-3"] | Resolved from EC-inventory: 247-536-3 from CAS 26248-24-8 |
| 237,626 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=3) |
| 237,627 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,628 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J169.478B","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['26248-24-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[23662540, 23670593, 23699607, 57376402]; selected_pubchem_cids=[23670593, 23699607, 57376402]; 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 |
| 251,315 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | rdkit_pre_consensus from 'CCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]'; added: molecular_mass, monoisotopic_mass |
| 272,039 | consensus_match | altLabel | [] | [{"@value":"Benzenesulfonic acid, tridecyl-, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | group_key=sodiumtridecylbenzenesulphonate||dimension=Environmental > media=Water > water_body=Long-term; cas=26248-24-8; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, tridecyl-, sodium salt, Benzenesulfonic acid, tridecyl-, sodium salt (1:1), Conoco C 650, Sodium <em>n</em>-tridecylbenzenesulfonate, Sodium tridecylbenzenesulfonate, Tridecylbenzenesulfonic acid sodium salt; object_uuid=fo-6f142d2bbb0d97a5 |
| 272,040 | consensus_match | cas_match_labels | — | {"26248-24-8":"exactMatch"} | group_key=sodiumtridecylbenzenesulphonate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory']; cas_sources={'26248-24-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-6f142d2bbb0d97a5: {'26248-24-8': 'exactMatch'} |
| 283,109 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | rdkit_post_consensus from 'CCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,944 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H31NaO3… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 3 candidate structures, so no one mass describes it |
| 292,542 | dedupe_altlabels | altLabel | [{"@value":"Benzenesulfonic acid, tridecyl-, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | [{"@value":"Benzenesulfonic acid, tridecyl-, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | Deduplicated altLabel values and removed entries matching prefLabel |
| 361,694 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/bc1be29e-d2b0-… | associations resolved on the elementary layer |
| 398,647 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1302361922970000/10976 | prefLabel | ef:agent/bootstrap_labels | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v0 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v1 |
| ef:activity/change/20260821T1302361922970000/10977 | name | ef:agent/bootstrap_labels | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v1 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v2 |
| ef:activity/change/20260821T1302361922970000/10978 | synonyms | ef:agent/bootstrap_labels | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v2 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v3 |
| ef:activity/change/20260821T1302361922970000/161340 | context | ef:agent/default_context_mapping | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v3 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v4 |
| ef:activity/change/20260821T1302361922970000/161341 | context_iri | ef:agent/default_context_mapping | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v4 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v5 |
| ef:activity/change/20260821T1302361922970000/216979 | unit_iri | ef:agent/unit_normalization | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v5 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v6 |
| ef:activity/change/20260821T1302361922970000/223654 | prefLabel | ef:agent/normalize_name_case | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v6 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v7 |
| ef:activity/change/20260821T1302361922970000/226927 | ec_numbers | ef:agent/ec_cross_check | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v7 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v8 |
| ef:activity/change/20260821T1302361922970000/237626 | properties | ef:agent/enrich_references | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v8 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v9 |
| ef:activity/change/20260821T1302361922970000/237627 | skos_definition | ef:agent/enrich_references | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v9 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v10 |
| ef:activity/change/20260821T1302361922970000/237628 | references | ef:agent/enrich_references | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v10 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v11 |
| ef:activity/change/20260821T1302361922970000/251315 | properties | ef:agent/rdkit_pre_consensus | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v11 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v12 |
| ef:activity/change/20260821T1302361922970000/272039 | altLabel | ef:agent/consensus_match | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v12 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v13 |
| ef:activity/change/20260821T1302361922970000/272040 | cas_match_labels | ef:agent/consensus_match | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v13 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v14 |
| ef:activity/change/20260821T1302361922970000/283109 | properties | ef:agent/rdkit_post_consensus | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v14 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v15 |
| ef:activity/change/20260821T1302361922970000/286944 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v15 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v16 |
| ef:activity/change/20260821T1302361922970000/292542 | altLabel | ef:agent/dedupe_altlabels | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v16 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v17 |
| ef:activity/change/20260821T1302361922970000/361694 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v17 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v18 |
| ef:activity/change/20260821T1302361922970000/398647 | types | ef:agent/link_flows_to_their_substance | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v18 | ef:flow/bc1be29e-d2b0-44d3-a80b-8f467e135fd4/v19 |