Tributyltin chloride
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-9ae4-0050c2490048
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 22323' (registry code), 'WR 3396' (grade code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=1461-22-9; cc_chebi_agreed_name='Tributyltin chloride'; object_uuid=fo-210690dcc1635940 |
| cas_match_labels | 1 | consensus_match | group_key=chlorotributyltin||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1461-22-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-210690dcc1635940: {'1461-22-9': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1461-22-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_79734']; candidate_pubchem_cids=[15096, 9927325, 87242266]; selected_pubchem_cids=[15096]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 17,703 | bootstrap_labels | prefLabel | — | [{"@value":"chlorotributyltin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Bootstrapped prefLabel from legacy name field |
| 17,704 | bootstrap_labels | name | chlorotributyltin | — | Purged legacy name field to enforce prefLabel usage |
| 17,705 | bootstrap_labels | synonyms | ["AB1002259","AC1L255E","Chlorid tri-N-butylcinicity","Chlorotri-n-butyltin","Chlorotributylstannane","I14-1699","Jsp00… | [] | Removed legacy synonyms field in favor of structured labels |
| 94,566 | 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 |
| 94,567 | 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 |
| 219,136 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,150 | normalize_name_case | prefLabel | [{"@value":"chlorotributyltin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | [{"@value":"Chlorotributyltin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 243,758 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 243,759 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,760 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.014.508","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['1461-22-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_79734']; candidate_pubchem_cids=[15096, 9927325, 87242266]; selected_pubchem_cids=[15096]; 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 |
| 253,094 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | rdkit_pre_consensus from 'CCCC[Sn](CCCC)(CCCC)Cl'; added: monoisotopic_mass |
| 256,708 | chebi_altlabels | altLabel | [] | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 265,105 | consensus_match | prefLabel | [{"@value":"Chlorotributyltin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | [{"@value":"Tributyltin chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | cas=1461-22-9; cc_chebi_agreed_name='Tributyltin chloride'; object_uuid=fo-210690dcc1635940 |
| 265,106 | consensus_match | altLabel | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | cas=1461-22-9; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-210690dcc1635940 |
| 265,107 | consensus_match | altLabel | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | group_key=chlorotributyltin||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=1461-22-9; added Common Chemistry CAS names as altLabel: Chlorotri-<em>n</em>-butylstannane, Chlorotri-<em>n</em>-butyltin, Chlorotributylstannane, Monochlorotributyltin, NSC 22323, Stannane, tributylchloro-, Tri-<em>n</em>-butylchlorostannane, Tri-<em>n</em>-butylstannyl chloride, Tributylchlorotin, Tributylstannyl chloride, WR 3396; object_uuid=fo-210690dcc1635940 |
| 265,108 | consensus_match | cas_match_labels | — | {"1461-22-9":"exactMatch"} | group_key=chlorotributyltin||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1461-22-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-210690dcc1635940: {'1461-22-9': 'exactMatch'} |
| 278,291 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tributyltin chloride' |
| 285,044 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | rdkit_post_consensus from 'CCC[CH2][Sn]([Cl])([CH2]CCC)[CH2]CCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,825 | strip_catalogue_altlabels | altLabel | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"Tri-n-butylchlorotin","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | Removed 2 catalogue altLabel value(s): 'NSC 22323' (registry code), 'WR 3396' (grade code) |
| 328,283 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 392,651 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27ClSn… | typed the way the ontology types it |
| 401,234 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260821T1122181958110000/17703 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v1 |
| ef:activity/change/20260821T1122181958110000/17704 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v2 |
| ef:activity/change/20260821T1122181958110000/17705 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v3 |
| ef:activity/change/20260821T1122181958110000/94566 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v4 |
| ef:activity/change/20260821T1122181958110000/94567 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v5 |
| ef:activity/change/20260821T1122181958110000/219136 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v6 |
| ef:activity/change/20260821T1122181958110000/225150 | prefLabel | ef:agent/normalize_name_case | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v7 |
| ef:activity/change/20260821T1122181958110000/243758 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v8 |
| ef:activity/change/20260821T1122181958110000/243759 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v9 |
| ef:activity/change/20260821T1122181958110000/243760 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v10 |
| ef:activity/change/20260821T1122181958110000/253094 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v11 |
| ef:activity/change/20260821T1122181958110000/256708 | altLabel | ef:agent/chebi_altlabels | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v12 |
| ef:activity/change/20260821T1122181958110000/265105 | prefLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v13 |
| ef:activity/change/20260821T1122181958110000/265106 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v14 |
| ef:activity/change/20260821T1122181958110000/265107 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v15 |
| ef:activity/change/20260821T1122181958110000/265108 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v16 |
| ef:activity/change/20260821T1122181958110000/278291 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v17 |
| ef:activity/change/20260821T1122181958110000/285044 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v18 |
| ef:activity/change/20260821T1122181958110000/290825 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v19 |
| ef:activity/change/20260821T1122181958110000/328283 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v19 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v20 |
| ef:activity/change/20260821T1122181958110000/392651 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v20 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v21 |
| ef:activity/change/20260821T1122181958110000/401234 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v21 | ef:flow/4d9a8790-3ddd-11dd-9ae4-0050c2490048/v22 |