8-oxa-3,5-dithia-4-stannatetradecanoic Acid, 10-ethyl-4,4-dioctyl-7-oxo-, 2-ethylhexyl Ester
Everything that changed this flow. Back to the flow
80ba2235-3abc-4d19-9312-cef02100ab9a
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 3 catalogue altLabel value(s): 'CAT 214' (grade code), 'Reatinor 847' (trade name), 'Thermolite 895' (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=8-oxa-3,5-dithia-4-stannatetradecanoicacid,10-ethyl-4,4-dioctyl-7-oxo-,2-ethylhexylester||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'15571-58-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-e90f41c05809c2ed: {'15571-58-1': '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 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['15571-58-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[9576033, 15978303, 102059829]; selected_pubchem_cids=[9576033, 15978303, 102059829]; 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 |
|---|---|---|---|---|---|
| 13,236 | bootstrap_labels | prefLabel | — | [{"@value":"8-oxa-3,5-dithia-4-stannatetradecanoic acid, 10-ethyl-4,4-dioctyl-7-oxo-, 2-ethylhexyl ester","@language":"… | Bootstrapped prefLabel from legacy name field |
| 13,237 | bootstrap_labels | name | 8-oxa-3,5-dithia-4-stannatetradecanoic acid, 10-ethyl-4,4-dioctyl-7-oxo-, 2-ethylhexyl ester | — | Purged legacy name field to enforce prefLabel usage |
| 13,238 | bootstrap_labels | synonyms | ["organometallic","2-ethylhexyl10-ethyl-4,4-dioctyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate","2-ethylhexyl10-ethy… | [] | Removed legacy synonyms field in favor of structured labels |
| 126,252 | 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 |
| 126,253 | 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 |
| 217,714 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,161 | normalize_name_case | prefLabel | [{"@value":"8-oxa-3,5-dithia-4-stannatetradecanoic acid, 10-ethyl-4,4-dioctyl-7-oxo-, 2-ethylhexyl ester","@language":"… | [{"@value":"8-oxa-3,5-dithia-4-stannatetradecanoic Acid, 10-ethyl-4,4-dioctyl-7-oxo-, 2-ethylhexyl Ester","@language":"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,729 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=3) |
| 239,730 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,731 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.211D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['15571-58-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[9576033, 15978303, 102059829]; selected_pubchem_cids=[9576033, 15978303, 102059829]; 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 |
| 251,923 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | rdkit_pre_consensus from 'CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-]'; added: molecular_mass, monoisotopic_mass |
| 263,351 | consensus_match | altLabel | [] | [{"@value":"17MOK","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus… | group_key=8-oxa-3,5-dithia-4-stannatetradecanoicacid,10-ethyl-4,4-dioctyl-7-oxo-,2-ethylhexylester||dimension=Environmental > media=Water > water_body=Unknown; cas=15571-58-1; added Common Chemistry CAS names as altLabel: 17MOK, 2-Ethylhexyl 10-ethyl-4,4-dioctyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate, Acetic acid, [(dioctylstannylene)dithio]di-, bis(2-ethylhexyl) ester, Advastab 17MOK, Advastab 17MOL, Bis(2-ethylhexyl thioglycolato)dioctyltin, Bis(2-ethylhexyl) [(dioctylstannylene)dithio]diacetate, CAT 214, Di-n-octyltin bis(2-ethylhexylmercaptoacetate), Di-n-octyltin bis(2-ethylhexylthioglycolate), Dioctylltin bis(2-ethylhexylmercaptoacetate), Dioctyltin bis(2-ethylhexyl thioglycolate), KS 2000A10, Reatinor 847, Thermolite 895, Tin, bis[(carboxymethyl)thio]dioctyl-, bis(2-ethylhexyl) ester; object_uuid=fo-e90f41c05809c2ed |
| 263,352 | consensus_match | cas_match_labels | — | {"15571-58-1":"exactMatch"} | group_key=8-oxa-3,5-dithia-4-stannatetradecanoicacid,10-ethyl-4,4-dioctyl-7-oxo-,2-ethylhexylester||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'15571-58-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-e90f41c05809c2ed: {'15571-58-1': 'exactMatch'} |
| 277,119 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '8-oxa-3,5-dithia-4-stannatetradecanoic Acid, 10-ethyl-4,4-dioctyl-7-oxo-, 2-ethylhexyl Ester' |
| 283,779 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | rdkit_post_consensus from 'CCCCCCC[CH2][Sn]([CH2]CCCCCCC)([S]CC(=O)OCC(CC)CCCC)[S]CC(=O)OCC(CC)CCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,975 | strip_catalogue_altlabels | altLabel | [{"@value":"17MOK","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus… | [{"@value":"17MOK","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus… | Removed 3 catalogue altLabel value(s): 'CAT 214' (grade code), 'Reatinor 847' (trade name), 'Thermolite 895' (trade name) |
| 344,128 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/80ba2235-3abc-… | associations resolved on the elementary layer |
| 391,468 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H72O4S2… | typed the way the ontology types it |
| 399,517 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260821T1554374006150000/13236 | prefLabel | ef:agent/bootstrap_labels | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v0 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v1 |
| ef:activity/change/20260821T1554374006150000/13237 | name | ef:agent/bootstrap_labels | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v1 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v2 |
| ef:activity/change/20260821T1554374006150000/13238 | synonyms | ef:agent/bootstrap_labels | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v2 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v3 |
| ef:activity/change/20260821T1554374006150000/126252 | context | ef:agent/default_context_mapping | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v3 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v4 |
| ef:activity/change/20260821T1554374006150000/126253 | context_iri | ef:agent/default_context_mapping | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v4 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v5 |
| ef:activity/change/20260821T1554374006150000/217714 | unit_iri | ef:agent/unit_normalization | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v5 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v6 |
| ef:activity/change/20260821T1554374006150000/224161 | prefLabel | ef:agent/normalize_name_case | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v6 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v7 |
| ef:activity/change/20260821T1554374006150000/239729 | properties | ef:agent/enrich_references | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v7 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v8 |
| ef:activity/change/20260821T1554374006150000/239730 | skos_definition | ef:agent/enrich_references | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v8 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v9 |
| ef:activity/change/20260821T1554374006150000/239731 | references | ef:agent/enrich_references | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v9 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v10 |
| ef:activity/change/20260821T1554374006150000/251923 | properties | ef:agent/rdkit_pre_consensus | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v10 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v11 |
| ef:activity/change/20260821T1554374006150000/263351 | altLabel | ef:agent/consensus_match | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v11 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v12 |
| ef:activity/change/20260821T1554374006150000/263352 | cas_match_labels | ef:agent/consensus_match | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v12 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v13 |
| ef:activity/change/20260821T1554374006150000/277119 | properties | ef:agent/opsin_iupac | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v13 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v14 |
| ef:activity/change/20260821T1554374006150000/283779 | properties | ef:agent/rdkit_post_consensus | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v14 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v15 |
| ef:activity/change/20260821T1554374006150000/289975 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v15 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v16 |
| ef:activity/change/20260821T1554374006150000/344128 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v16 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v17 |
| ef:activity/change/20260821T1554374006150000/391468 | properties | ef:agent/normalise_property_values | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v17 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v18 |
| ef:activity/change/20260821T1554374006150000/399517 | types | ef:agent/link_flows_to_their_substance | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v18 | ef:flow/80ba2235-3abc-4d19-9312-cef02100ab9a/v19 |