Sodium Dioctyl Sulfosuccinate
Everything that changed this flow. Back to the flow
b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, 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): 'NSC 7779' (registry code), 'Surfacpol 203' (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=sodiumdioctylsulfosuccinate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1639-66-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-044770bf4d4d7368: {'1639-66-3': '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 soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1639-66-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[15426, 517065, 21867904, 53249634, 76970093]; selected_pubchem_cids=[53249634]; 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 |
|---|---|---|---|---|---|
| 10,191 | bootstrap_labels | prefLabel | — | [{"@value":"sodium dioctyl sulfosuccinate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Bootstrapped prefLabel from legacy name field |
| 10,192 | bootstrap_labels | name | sodium dioctyl sulfosuccinate | — | Purged legacy name field to enforce prefLabel usage |
| 10,193 | bootstrap_labels | synonyms | ["1,4-Bis(n-octyl) sulfobutanedioate, sodium salt","AC1LANVZ","Bu-cerumen","Butanedioic acid, 2-sulfo-, 1,4-dioctyl est… | [] | Removed legacy synonyms field in favor of structured labels |
| 157,722 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 157,723 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 216,723 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,476 | normalize_name_case | prefLabel | [{"@value":"sodium dioctyl sulfosuccinate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | [{"@value":"Sodium Dioctyl Sulfosuccinate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,906 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,907 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,908 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.015.168","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['1639-66-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[15426, 517065, 21867904, 53249634, 76970093]; selected_pubchem_cids=[53249634]; 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 |
| 251,113 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | rdkit_pre_consensus from 'CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)O.[Na]'; added: molecular_mass, monoisotopic_mass |
| 271,899 | consensus_match | altLabel | [] | [{"@value":"Butanedioic acid, 2-sulfo-, 1,4-dioctyl ester, sodium salt (1:1)","@language":"en","source":{"prov:wasGener… | group_key=sodiumdioctylsulfosuccinate||dimension=Environmental > media=Water > water_body=Unknown; cas=1639-66-3; added Common Chemistry CAS names as altLabel: Butanedioic acid, 2-sulfo-, 1,4-dioctyl ester, sodium salt (1:1), Butanedioic acid, sulfo-, 1,4-dioctyl ester, sodium salt, Dioctyl sodiosulfosuccinate, Dioctylsulfosuccinic acid sodium salt, MKC, NSC 7779, Neocol SW 30, Octyl alcohol, sulfosuccinate (1:2) sodium salt, Penetrant T, Penetrating T, Sodium 1,2-bis(octyloxycarbonyl)-1-ethanesulfonate, Sodium di-<em>n</em>-octyl sulfosuccinate, Succinic acid, sulfo-, 1,4-dioctyl ester, sodium salt, Succinic acid, sulfo-, dioctyl ester, <em>S</em>-sodium salt, Succinic acid, sulfo-, dioctyl ester, Na salt, Surfacpol 203, Texapon DOS; object_uuid=fo-044770bf4d4d7368 |
| 271,900 | consensus_match | cas_match_labels | — | {"1639-66-3":"exactMatch"} | group_key=sodiumdioctylsulfosuccinate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1639-66-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-044770bf4d4d7368: {'1639-66-3': 'exactMatch'} |
| 282,889 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | rdkit_post_consensus from 'CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)O.[Na]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,376 | strip_catalogue_altlabels | altLabel | [{"@value":"Butanedioic acid, 2-sulfo-, 1,4-dioctyl ester, sodium salt (1:1)","@language":"en","source":{"prov:wasGener… | [{"@value":"Butanedioic acid, 2-sulfo-, 1,4-dioctyl ester, sodium salt (1:1)","@language":"en","source":{"prov:wasGener… | Removed 2 catalogue altLabel value(s): 'NSC 7779' (registry code), 'Surfacpol 203' (trade name) |
| 359,886 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b5c3dfd0-438b-… | associations resolved on the elementary layer |
| 390,643 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H38NaO7… | typed the way the ontology types it |
| 398,342 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | 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/20260821T1554374006150000/10191 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v0 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v1 |
| ef:activity/change/20260821T1554374006150000/10192 | name | ef:agent/bootstrap_labels | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v1 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v2 |
| ef:activity/change/20260821T1554374006150000/10193 | synonyms | ef:agent/bootstrap_labels | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v2 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v3 |
| ef:activity/change/20260821T1554374006150000/157722 | context | ef:agent/default_context_mapping | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v3 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v4 |
| ef:activity/change/20260821T1554374006150000/157723 | context_iri | ef:agent/default_context_mapping | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v4 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v5 |
| ef:activity/change/20260821T1554374006150000/216723 | unit_iri | ef:agent/unit_normalization | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v5 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v6 |
| ef:activity/change/20260821T1554374006150000/223476 | prefLabel | ef:agent/normalize_name_case | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v6 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v7 |
| ef:activity/change/20260821T1554374006150000/236906 | properties | ef:agent/enrich_references | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v7 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v8 |
| ef:activity/change/20260821T1554374006150000/236907 | skos_definition | ef:agent/enrich_references | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v8 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v9 |
| ef:activity/change/20260821T1554374006150000/236908 | references | ef:agent/enrich_references | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v9 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v10 |
| ef:activity/change/20260821T1554374006150000/251113 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v10 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v11 |
| ef:activity/change/20260821T1554374006150000/271899 | altLabel | ef:agent/consensus_match | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v11 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v12 |
| ef:activity/change/20260821T1554374006150000/271900 | cas_match_labels | ef:agent/consensus_match | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v12 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v13 |
| ef:activity/change/20260821T1554374006150000/282889 | properties | ef:agent/rdkit_post_consensus | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v13 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v14 |
| ef:activity/change/20260821T1554374006150000/289376 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v14 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v15 |
| ef:activity/change/20260821T1554374006150000/359886 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v15 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v16 |
| ef:activity/change/20260821T1554374006150000/390643 | properties | ef:agent/normalise_property_values | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v16 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v17 |
| ef:activity/change/20260821T1554374006150000/398342 | types | ef:agent/link_flows_to_their_substance | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v17 | ef:flow/b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b/v18 |