Butane-1,3-diol
Everything that changed this flow. Back to the flow
2c328702-36c3-4a1d-94e5-e3297b0381b2
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 402145' (registry 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=butane-1,3-diol||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'107-88-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3b086a0143347491: {'107-88-0': '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 air, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['107-88-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_52683']; candidate_pubchem_cids=[7896, 252524, 446973, 13634622]; selected_pubchem_cids=[7896]; 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 |
|---|---|---|---|---|---|
| 20,141 | bootstrap_labels | prefLabel | — | [{"@value":"butane-1,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Bootstrapped prefLabel from legacy name field |
| 20,142 | bootstrap_labels | name | butane-1,3-diol | — | Purged legacy name field to enforce prefLabel usage |
| 20,143 | bootstrap_labels | synonyms | ["butane-1,3-diol","1,3-butyleneglycol","haisugarcanebg","haisugarcanebg-r","naturobg","(+/-)-butane-1,3-diol","(3r)-bu… | [] | Removed legacy synonyms field in favor of structured labels |
| 66,301 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 66,302 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 219,876 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,666 | normalize_name_case | prefLabel | [{"@value":"butane-1,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | [{"@value":"Butane-1,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 245,827 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 245,828 | enrich_references | skos_definition | — | [{"@value":"A butanediol compound having two hydroxy groups in the 1- and 3-positions.","@language":"en","provenance":{… | Merged ChEBI/PubChem definitions into skos:definition |
| 245,829 | enrich_references | references | [] | [{"@id":"gmelin:2409","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"brigh… | Added references with provenance; cas_numbers=['107-88-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_52683']; candidate_pubchem_cids=[7896, 252524, 446973, 13634622]; selected_pubchem_cids=[7896]; 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 |
| 256,989 | chebi_altlabels | altLabel | [] | [{"@value":"(RS)-1,3-Butandiol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | Added 10 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 264,537 | consensus_match | altLabel | [{"@value":"(RS)-1,3-Butandiol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | [{"@value":"(RS)-1,3-Butandiol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | group_key=butane-1,3-diol||dimension=Environmental > media=Air > strata=Long-term; cas=107-88-0; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-1,3-Butanediol, (±)-Butane-1,3-diol, 1,3-Butylene glycol P, 13BGK, 3-Hydroxy-1-butanol, <span class="text-smallcaps">DL</span>-1,3-Butanediol, Butylene glycol, Celtol 1,3-BG, Haisugarcane BG, Jeechem Bugl, NSC 402145, Niax DP 1022, β-Butylene glycol; object_uuid=fo-3b086a0143347491 |
| 264,538 | consensus_match | cas_match_labels | — | {"107-88-0":"exactMatch"} | group_key=butane-1,3-diol||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'107-88-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3b086a0143347491: {'107-88-0': 'exactMatch'} |
| 278,910 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Butane-1,3-diol' |
| 285,718 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | rdkit_post_consensus from 'CC(O)CCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,286 | strip_catalogue_altlabels | altLabel | [{"@value":"(RS)-1,3-Butandiol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | [{"@value":"(RS)-1,3-Butandiol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | Removed 1 catalogue altLabel value(s): 'NSC 402145' (registry code) |
| 314,208 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2c328702-36c3-… | associations resolved on the elementary layer |
| 393,315 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10O2"],… | typed the way the ontology types it |
| 402,196 | 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/20261019T0712047113160000/20141 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v0 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v1 |
| ef:activity/change/20261019T0712047113160000/20142 | name | ef:agent/bootstrap_labels | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v1 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v2 |
| ef:activity/change/20261019T0712047113160000/20143 | synonyms | ef:agent/bootstrap_labels | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v2 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v3 |
| ef:activity/change/20261019T0712047113160000/66301 | context | ef:agent/default_context_mapping | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v3 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v4 |
| ef:activity/change/20261019T0712047113160000/66302 | context_iri | ef:agent/default_context_mapping | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v4 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v5 |
| ef:activity/change/20261019T0712047113160000/219876 | unit_iri | ef:agent/unit_normalization | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v5 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v6 |
| ef:activity/change/20261019T0712047113160000/225666 | prefLabel | ef:agent/normalize_name_case | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v6 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v7 |
| ef:activity/change/20261019T0712047113160000/245827 | properties | ef:agent/enrich_references | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v7 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v8 |
| ef:activity/change/20261019T0712047113160000/245828 | skos_definition | ef:agent/enrich_references | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v8 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v9 |
| ef:activity/change/20261019T0712047113160000/245829 | references | ef:agent/enrich_references | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v9 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v10 |
| ef:activity/change/20261019T0712047113160000/256989 | altLabel | ef:agent/chebi_altlabels | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v10 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v11 |
| ef:activity/change/20261019T0712047113160000/264537 | altLabel | ef:agent/consensus_match | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v11 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v12 |
| ef:activity/change/20261019T0712047113160000/264538 | cas_match_labels | ef:agent/consensus_match | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v12 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v13 |
| ef:activity/change/20261019T0712047113160000/278910 | properties | ef:agent/opsin_iupac | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v13 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v14 |
| ef:activity/change/20261019T0712047113160000/285718 | properties | ef:agent/rdkit_post_consensus | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v14 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v15 |
| ef:activity/change/20261019T0712047113160000/291286 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v15 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v16 |
| ef:activity/change/20261019T0712047113160000/314208 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v16 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v17 |
| ef:activity/change/20261019T0712047113160000/393315 | properties | ef:agent/normalise_property_values | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v17 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v18 |
| ef:activity/change/20261019T0712047113160000/402196 | types | ef:agent/link_flows_to_their_substance | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v18 | ef:flow/2c328702-36c3-4a1d-94e5-e3297b0381b2/v19 |