1,1'-disulfanediyldioctadecane
Everything that changed this flow. Back to the flow
2804a2d3-72b7-4712-a728-b7a022c2b038
By field
13 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 | 2 | consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 12046' (registry code), 'TMSE 10' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=1,1'-disulfanediyldioctadecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'2500-88-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-31abf1600281914d: {'2500-88-1': '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 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 agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['2500-88-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[75627, 3034131]; selected_pubchem_cids=[75627]; 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 |
|---|---|---|---|---|---|
| 19,422 | bootstrap_labels | prefLabel | — | [{"@value":"1,1'-disulfanediyldioctadecane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Bootstrapped prefLabel from legacy name field |
| 19,423 | bootstrap_labels | name | 1,1'-disulfanediyldioctadecane | — | Purged legacy name field to enforce prefLabel usage |
| 19,424 | bootstrap_labels | synonyms | ["organic","dioctadecyldisulphide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 62,796 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 62,797 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 219,667 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 245,241 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 245,242 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 245,243 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J97.262B","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['2500-88-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[75627, 3034131]; selected_pubchem_cids=[75627]; 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 |
| 253,528 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCCCCSSCCCCCCCCCCCCCCCCCC'; added: molecular_mass, monoisotopic_mass |
| 258,048 | consensus_match | altLabel | [] | [{"@value":"1-(Octadecyldisulfanyl)octadecane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | group_key=1,1'-disulfanediyldioctadecane||dimension=Environmental > media=Ground > geography=Agricultural; cas=2500-88-1; added Common Chemistry CAS names as altLabel: 1-(Octadecyldisulfanyl)octadecane, Bis(1-octadecyl) disulfide, Di-<em>n</em>-octadecyl disulfide, Dioctadecyl disulfide, Distearyl disulfide, Disulfide, dioctadecyl, Hostanox SE 10, NSC 12046, Octadecyl disulfide, TMSE 10; object_uuid=fo-31abf1600281914d |
| 258,049 | consensus_match | cas_match_labels | — | {"2500-88-1":"exactMatch"} | group_key=1,1'-disulfanediyldioctadecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'2500-88-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-31abf1600281914d: {'2500-88-1': 'exactMatch'} |
| 278,757 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,1'-disulfanediyldioctadecane' |
| 285,541 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | rdkit_post_consensus from 'CCCCCCCCCCCCCCCCCCSSCCCCCCCCCCCCCCCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,182 | strip_catalogue_altlabels | altLabel | [{"@value":"1-(Octadecyldisulfanyl)octadecane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | [{"@value":"1-(Octadecyldisulfanyl)octadecane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | Removed 2 catalogue altLabel value(s): 'NSC 12046' (registry code), 'TMSE 10' (grade code) |
| 312,436 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2804a2d3-72b7-… | associations resolved on the elementary layer |
| 393,127 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H74S2"]… | typed the way the ontology types it |
| 401,912 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260820T0738569779880000/19422 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v0 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v1 |
| ef:activity/change/20260820T0738569779880000/19423 | name | ef:agent/bootstrap_labels | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v1 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v2 |
| ef:activity/change/20260820T0738569779880000/19424 | synonyms | ef:agent/bootstrap_labels | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v2 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v3 |
| ef:activity/change/20260820T0738569779880000/62796 | context | ef:agent/default_context_mapping | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v3 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v4 |
| ef:activity/change/20260820T0738569779880000/62797 | context_iri | ef:agent/default_context_mapping | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v4 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v5 |
| ef:activity/change/20260820T0738569779880000/219667 | unit_iri | ef:agent/unit_normalization | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v5 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v6 |
| ef:activity/change/20260820T0738569779880000/245241 | properties | ef:agent/enrich_references | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v6 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v7 |
| ef:activity/change/20260820T0738569779880000/245242 | skos_definition | ef:agent/enrich_references | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v7 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v8 |
| ef:activity/change/20260820T0738569779880000/245243 | references | ef:agent/enrich_references | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v8 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v9 |
| ef:activity/change/20260820T0738569779880000/253528 | properties | ef:agent/rdkit_pre_consensus | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v9 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v10 |
| ef:activity/change/20260820T0738569779880000/258048 | altLabel | ef:agent/consensus_match | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v10 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v11 |
| ef:activity/change/20260820T0738569779880000/258049 | cas_match_labels | ef:agent/consensus_match | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v11 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v12 |
| ef:activity/change/20260820T0738569779880000/278757 | properties | ef:agent/opsin_iupac | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v12 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v13 |
| ef:activity/change/20260820T0738569779880000/285541 | properties | ef:agent/rdkit_post_consensus | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v13 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v14 |
| ef:activity/change/20260820T0738569779880000/291182 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v14 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v15 |
| ef:activity/change/20260820T0738569779880000/312436 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v15 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v16 |
| ef:activity/change/20260820T0738569779880000/393127 | properties | ef:agent/normalise_property_values | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v16 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v17 |
| ef:activity/change/20260820T0738569779880000/401912 | types | ef:agent/link_flows_to_their_substance | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v17 | ef:flow/2804a2d3-72b7-4712-a728-b7a022c2b038/v18 |