2-ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate
Everything that changed this flow. Back to the flow
ef467b2a-479f-446a-82d8-fefccf76213e
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): 'Mark 17M' (grade code), 'Mark 292' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=2-ethylhexyl4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'10584-98-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e335525b28f91305: {'10584-98-2': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['10584-98-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[9571022, 101586614]; selected_pubchem_cids=[9571022, 101586614]; 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 |
|---|---|---|---|---|---|
| 18,356 | bootstrap_labels | prefLabel | — | [{"@value":"2-ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate","@language":"en","sourc… | Bootstrapped prefLabel from legacy name field |
| 18,357 | bootstrap_labels | name | 2-ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate | — | Purged legacy name field to enforce prefLabel usage |
| 18,358 | bootstrap_labels | synonyms | ["organometallic","2-ethylhexyl4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate","mark292-s","markt21… | [] | Removed legacy synonyms field in favor of structured labels |
| 192,776 | 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 |
| 192,777 | 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 |
| 219,339 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 244,338 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 244,339 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,340 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.298E","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['10584-98-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[9571022, 101586614]; selected_pubchem_cids=[9571022, 101586614]; 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 |
| 253,261 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | rdkit_pre_consensus from 'CCCCC(CC)COC(=O)CS[Sn](CCCC)(CCCC)SCC(=O)OCC(CC)CCCC'; added: molecular_mass, monoisotopic_mass |
| 260,828 | consensus_match | altLabel | [] | [{"@value":"2-Ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate","@language":"en","source":… | group_key=2-ethylhexyl4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=10584-98-2; added Common Chemistry CAS names as altLabel: 2-Ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate, 8-Oxa-3,5-dithia-4-stannatetradecanoic acid, 4,4-dibutyl-10-ethyl-7-oxo-, 2-ethylhexyl ester, Acetic acid, [(dibutylstannylene)dithio]di-, bis(2-ethylhexyl) ester, Di-n-butyltin bis(2-ethylhexylmercaptoacetate), Dibutyltin bis(2-ethylhexyl mercaptoacetate), Dibutyltin bis(2-ethylhexyl thioglycolate), Mark 17M, Mark 292, Mellite 31, Tin, dibutylbis[(carboxymethyl)thio]-, bis(2-ethylhexyl) ester, Tinstab BTS 71S; object_uuid=fo-e335525b28f91305 |
| 260,829 | consensus_match | cas_match_labels | — | {"10584-98-2":"exactMatch"} | group_key=2-ethylhexyl4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'10584-98-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e335525b28f91305: {'10584-98-2': 'exactMatch'} |
| 278,471 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate' |
| 285,235 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | rdkit_post_consensus from 'CCCCC(CC)COC(=O)C[S][Sn]([CH2]CCC)([CH2]CCC)[S]CC(=O)OCC(CC)CCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,949 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate","@language":"en","source":… | [{"@value":"2-Ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate","@language":"en","source":… | Removed 2 catalogue altLabel value(s): 'Mark 17M' (grade code), 'Mark 292' (grade code) |
| 377,420 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/ef467b2a-479f-… | associations resolved on the elementary layer |
| 392,839 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H56O4S2… | typed the way the ontology types it |
| 401,495 | 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/20260821T1302361922970000/18356 | prefLabel | ef:agent/bootstrap_labels | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v0 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v1 |
| ef:activity/change/20260821T1302361922970000/18357 | name | ef:agent/bootstrap_labels | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v1 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v2 |
| ef:activity/change/20260821T1302361922970000/18358 | synonyms | ef:agent/bootstrap_labels | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v2 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v3 |
| ef:activity/change/20260821T1302361922970000/192776 | context | ef:agent/default_context_mapping | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v3 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v4 |
| ef:activity/change/20260821T1302361922970000/192777 | context_iri | ef:agent/default_context_mapping | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v4 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v5 |
| ef:activity/change/20260821T1302361922970000/219339 | unit_iri | ef:agent/unit_normalization | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v5 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v6 |
| ef:activity/change/20260821T1302361922970000/244338 | properties | ef:agent/enrich_references | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v6 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v7 |
| ef:activity/change/20260821T1302361922970000/244339 | skos_definition | ef:agent/enrich_references | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v7 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v8 |
| ef:activity/change/20260821T1302361922970000/244340 | references | ef:agent/enrich_references | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v8 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v9 |
| ef:activity/change/20260821T1302361922970000/253261 | properties | ef:agent/rdkit_pre_consensus | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v9 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v10 |
| ef:activity/change/20260821T1302361922970000/260828 | altLabel | ef:agent/consensus_match | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v10 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v11 |
| ef:activity/change/20260821T1302361922970000/260829 | cas_match_labels | ef:agent/consensus_match | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v11 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v12 |
| ef:activity/change/20260821T1302361922970000/278471 | properties | ef:agent/opsin_iupac | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v12 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v13 |
| ef:activity/change/20260821T1302361922970000/285235 | properties | ef:agent/rdkit_post_consensus | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v13 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v14 |
| ef:activity/change/20260821T1302361922970000/290949 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v14 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v15 |
| ef:activity/change/20260821T1302361922970000/377420 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v15 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v16 |
| ef:activity/change/20260821T1302361922970000/392839 | properties | ef:agent/normalise_property_values | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v16 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v17 |
| ef:activity/change/20260821T1302361922970000/401495 | types | ef:agent/link_flows_to_their_substance | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v17 | ef:flow/ef467b2a-479f-446a-82d8-fefccf76213e/v18 |