Aluminum Tripropan-2-olate
Everything that changed this flow. Back to the flow
6df5ac39-6a87-486d-ae23-1e03011f7884
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 3 catalogue altLabel value(s): 'A 1010' (grade code), 'Manalox 130' (trade name), 'Manalox 360' (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=aluminumtripropan-2-olate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'555-31-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8e85bdaf0af99f56: {'555-31-7': '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 air > Emissions to lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['555-31-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[3776, 11143, 16685055, 45051571, 50931157, 70700058]; selected_pubchem_cids=[45051571]; 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 |
|---|---|---|---|---|---|
| 2,285 | bootstrap_labels | prefLabel | — | [{"@value":"aluminum tripropan-2-olate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | Bootstrapped prefLabel from legacy name field |
| 2,286 | bootstrap_labels | name | aluminum tripropan-2-olate | — | Purged legacy name field to enforce prefLabel usage |
| 2,287 | bootstrap_labels | synonyms | ["organometallic","aluminiumtriisopropanolate","aluminium-tri-isopropoxide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 115,282 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 115,283 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 214,101 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,616 | normalize_name_case | prefLabel | [{"@value":"aluminum tripropan-2-olate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | [{"@value":"Aluminum Tripropan-2-olate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,377 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,378 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,379 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=555-31-7","provenance":{"prov:wasGeneratedBy":"enrich_references… | Added references with provenance; cas_numbers=['555-31-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[3776, 11143, 16685055, 45051571, 50931157, 70700058]; selected_pubchem_cids=[45051571]; 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 |
| 248,952 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO"],… | rdkit_pre_consensus from 'CC(C)O.[Al]'; added: molecular_mass, monoisotopic_mass |
| 263,729 | consensus_match | altLabel | [] | [{"@value":"2-Propanol, aluminum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttr… | group_key=aluminumtripropan-2-olate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=555-31-7; added Common Chemistry CAS names as altLabel: 2-Propanol, aluminum salt, 2-Propanol, aluminum salt (3:1), A 1010, AIPD, Aliso, Aluminium isopropoxide, Aluminium trisopropoxide, Aluminum 2-propoxide, Aluminum <em>sec</em>-propanolate, Aluminum isopropanolate, Aluminum isopropioate, Aluminum isopropoxide, Aluminum isopropoxide (1:3), Aluminum isopropylate, Aluminum isopropylate (Al(OC<sub>3</sub>H<sub>7</sub>)<sub>3</sub>), Aluminum triisopropoxide, Aluminum triisopropylate, Aluminum tris(<em>iso</em>-propoxide), Aluminum tris(<em>sec</em>-propoxide), Aluminum tris(isopropoxide), Aluminum tris(isopropylate), Aluminum(3+) isopropoxide, Isopropanol aluminum salt, Isopropyl alcohol, aluminum salt, Manalox 130, Manalox 360, PADM, SYM-AL 04, Triisopropoxyaluminum, Triisopropyl aluminate, Triisopropyloxyaluminum, Tris(isopropanolato)aluminum, Tris(isopropoxide)aluminum, Tris(isopropoxy)aluminum; object_uuid=fo-8e85bdaf0af99f56 |
| 263,730 | consensus_match | cas_match_labels | — | {"555-31-7":"exactMatch"} | group_key=aluminumtripropan-2-olate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'555-31-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8e85bdaf0af99f56: {'555-31-7': 'exactMatch'} |
| 274,071 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Aluminum Tripropan-2-olate' |
| 280,482 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO","… | rdkit_post_consensus from 'CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,651 | withhold_contradicted_composition | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8AlO","… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21AlO3"… | withhold_contradicted_composition: the registry registers [(('Al', 1), ('C', 9), ('O', 3))], contradicting ['C3H8AlO'] from ['enrich_references.pubchem_semantic']; withdrew inchi2d_key_string x1, molecular_formula x1 |
| 287,704 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Propanol, aluminum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttr… | [{"@value":"2-Propanol, aluminum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttr… | Removed 3 catalogue altLabel value(s): 'A 1010' (grade code), 'Manalox 130' (trade name), 'Manalox 360' (trade name) |
| 338,640 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6df5ac39-6a87-… | associations resolved on the elementary layer |
| 388,361 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21AlO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21AlO3"… | typed the way the ontology types it |
| 395,067 | 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/20260821T1554374006150000/2285 | prefLabel | ef:agent/bootstrap_labels | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v0 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v1 |
| ef:activity/change/20260821T1554374006150000/2286 | name | ef:agent/bootstrap_labels | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v1 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v2 |
| ef:activity/change/20260821T1554374006150000/2287 | synonyms | ef:agent/bootstrap_labels | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v2 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v3 |
| ef:activity/change/20260821T1554374006150000/115282 | context | ef:agent/default_context_mapping | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v3 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v4 |
| ef:activity/change/20260821T1554374006150000/115283 | context_iri | ef:agent/default_context_mapping | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v4 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v5 |
| ef:activity/change/20260821T1554374006150000/214101 | unit_iri | ef:agent/unit_normalization | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v5 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v6 |
| ef:activity/change/20260821T1554374006150000/221616 | prefLabel | ef:agent/normalize_name_case | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v6 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v7 |
| ef:activity/change/20260821T1554374006150000/229377 | properties | ef:agent/enrich_references | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v7 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v8 |
| ef:activity/change/20260821T1554374006150000/229378 | skos_definition | ef:agent/enrich_references | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v8 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v9 |
| ef:activity/change/20260821T1554374006150000/229379 | references | ef:agent/enrich_references | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v9 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v10 |
| ef:activity/change/20260821T1554374006150000/248952 | properties | ef:agent/rdkit_pre_consensus | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v10 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v11 |
| ef:activity/change/20260821T1554374006150000/263729 | altLabel | ef:agent/consensus_match | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v11 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v12 |
| ef:activity/change/20260821T1554374006150000/263730 | cas_match_labels | ef:agent/consensus_match | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v12 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v13 |
| ef:activity/change/20260821T1554374006150000/274071 | properties | ef:agent/opsin_iupac | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v13 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v14 |
| ef:activity/change/20260821T1554374006150000/280482 | properties | ef:agent/rdkit_post_consensus | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v14 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v15 |
| ef:activity/change/20260821T1554374006150000/286651 | properties | ef:agent/withhold_contradicted_composition | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v15 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v16 |
| ef:activity/change/20260821T1554374006150000/287704 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v16 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v17 |
| ef:activity/change/20260821T1554374006150000/338640 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v17 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v18 |
| ef:activity/change/20260821T1554374006150000/388361 | properties | ef:agent/normalise_property_values | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v18 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v19 |
| ef:activity/change/20260821T1554374006150000/395067 | types | ef:agent/link_flows_to_their_substance | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v19 | ef:flow/6df5ac39-6a87-486d-ae23-1e03011f7884/v20 |