Aluminum Tributan-2-olate
Everything that changed this flow. Back to the flow
abf108bf-b88c-430e-b02e-aefdb8215af8
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_contradicted_composition | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'A 1001 (catalyst)' (grade code), 'AL 3001' (grade code) |
| 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=aluminumtributan-2-olate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'2269-22-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f17815337ecdb21c: {'2269-22-9': '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 non-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 non-agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['2269-22-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[61289, 6451513, 16685157, 50931103, 70700009, 87879406, 163199248]; selected_pubchem_cids=[87879406]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 4,877 | bootstrap_labels | prefLabel | — | [{"@value":"aluminum tributan-2-olate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Bootstrapped prefLabel from legacy name field |
| 4,878 | bootstrap_labels | name | aluminum tributan-2-olate | — | Purged legacy name field to enforce prefLabel usage |
| 4,879 | bootstrap_labels | synonyms | ["organometallic","aluminiumtri-sec-butanolate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 152,076 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 152,077 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 214,968 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,218 | normalize_name_case | prefLabel | [{"@value":"aluminum tributan-2-olate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | [{"@value":"Aluminum Tributan-2-olate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 231,864 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10AlO"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,865 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,866 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=2269-22-9","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['2269-22-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[61289, 6451513, 16685157, 50931103, 70700009, 87879406, 163199248]; selected_pubchem_cids=[87879406]; 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 |
| 249,661 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10AlO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10AlO"]… | rdkit_pre_consensus from 'CCC(C)O.[Al]'; added: molecular_mass, monoisotopic_mass |
| 263,721 | consensus_match | altLabel | [] | [{"@value":"2-Butanol, aluminum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | group_key=aluminumtributan-2-olate||dimension=Environmental > media=Water > water_body=Unknown; cas=2269-22-9; added Common Chemistry CAS names as altLabel: 2-Butanol, aluminum salt, 2-Butanol, aluminum salt (3:1), <em>sec</em>-Butyl alcohol, aluminum salt, A 1001 (catalyst), AL 3001, ASB, ASB (salt), ASBD, Aluminium tri-<em>sec</em>-butoxide, Aluminum 2-butoxide, Aluminum <em>sec</em>-butanolate, Aluminum <em>sec</em>-butoxide, Aluminum <em>sec</em>-butylate, Aluminum tri(<em>sec</em>-butylate), Aluminum tri-<em>s</em>-butoxide, Aluminum tri-<em>sec</em>-butoxide, Aluminum tris(<em>sec</em>-butoxide), Orgatix AL 3001, Tri-<em>sec</em>-butoxyaluminum, Tris(2-butanolato)aluminum, Tris(2-butoxy)aluminum, Tris(<em>sec</em>-butoxy)aluminum; object_uuid=fo-f17815337ecdb21c |
| 263,722 | consensus_match | cas_match_labels | — | {"2269-22-9":"exactMatch"} | group_key=aluminumtributan-2-olate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'2269-22-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f17815337ecdb21c: {'2269-22-9': 'exactMatch'} |
| 274,795 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10AlO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10AlO"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Aluminum Tributan-2-olate' |
| 281,265 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10AlO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27AlO3… | rdkit_post_consensus from 'CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].[Al+3]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,659 | withhold_contradicted_composition | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27AlO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27AlO3… | withhold_contradicted_composition: the registry registers [(('Al', 1), ('C', 12), ('O', 3))], contradicting ['C4H10AlO'] from ['enrich_references.pubchem_semantic']; withdrew inchi2d_key_string x1, molecular_formula x1 |
| 288,259 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Butanol, aluminum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | [{"@value":"2-Butanol, aluminum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | Removed 2 catalogue altLabel value(s): 'A 1001 (catalyst)' (grade code), 'AL 3001' (grade code) |
| 357,061 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/abf108bf-b88c-… | associations resolved on the elementary layer |
| 389,104 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27AlO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H27AlO3… | typed the way the ontology types it |
| 396,118 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T1554374006150000/4877 | prefLabel | ef:agent/bootstrap_labels | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v0 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v1 |
| ef:activity/change/20260821T1554374006150000/4878 | name | ef:agent/bootstrap_labels | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v1 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v2 |
| ef:activity/change/20260821T1554374006150000/4879 | synonyms | ef:agent/bootstrap_labels | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v2 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v3 |
| ef:activity/change/20260821T1554374006150000/152076 | context | ef:agent/default_context_mapping | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v3 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v4 |
| ef:activity/change/20260821T1554374006150000/152077 | context_iri | ef:agent/default_context_mapping | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v4 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v5 |
| ef:activity/change/20260821T1554374006150000/214968 | unit_iri | ef:agent/unit_normalization | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v5 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v6 |
| ef:activity/change/20260821T1554374006150000/222218 | prefLabel | ef:agent/normalize_name_case | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v6 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v7 |
| ef:activity/change/20260821T1554374006150000/231864 | properties | ef:agent/enrich_references | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v7 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v8 |
| ef:activity/change/20260821T1554374006150000/231865 | skos_definition | ef:agent/enrich_references | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v8 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v9 |
| ef:activity/change/20260821T1554374006150000/231866 | references | ef:agent/enrich_references | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v9 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v10 |
| ef:activity/change/20260821T1554374006150000/249661 | properties | ef:agent/rdkit_pre_consensus | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v10 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v11 |
| ef:activity/change/20260821T1554374006150000/263721 | altLabel | ef:agent/consensus_match | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v11 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v12 |
| ef:activity/change/20260821T1554374006150000/263722 | cas_match_labels | ef:agent/consensus_match | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v12 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v13 |
| ef:activity/change/20260821T1554374006150000/274795 | properties | ef:agent/opsin_iupac | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v13 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v14 |
| ef:activity/change/20260821T1554374006150000/281265 | properties | ef:agent/rdkit_post_consensus | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v14 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v15 |
| ef:activity/change/20260821T1554374006150000/286659 | properties | ef:agent/withhold_contradicted_composition | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v15 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v16 |
| ef:activity/change/20260821T1554374006150000/288259 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v16 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v17 |
| ef:activity/change/20260821T1554374006150000/357061 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v17 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v18 |
| ef:activity/change/20260821T1554374006150000/389104 | properties | ef:agent/normalise_property_values | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v18 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v19 |
| ef:activity/change/20260821T1554374006150000/396118 | types | ef:agent/link_flows_to_their_substance | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v19 | ef:flow/abf108bf-b88c-430e-b02e-aefdb8215af8/v20 |