Butane-2,3-diol
Everything that changed this flow. Back to the flow
50b1a53a-95ca-4ebb-a257-b15f96e21684
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 | 2 | chebi_altlabels, consensus_match | group_key=butane-2,3-diol||dimension=Environmental > media=Air > strata=Unknown; cas=513-85-9; added Common Chemistry CAS names as altLabel: 1,2-Dimethyl-1,2-ethanediol; object_uuid=fo-23a92457b5de79de |
| 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-2,3-diol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'513-85-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-23a92457b5de79de: {'513-85-9': '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 water > Emissions to fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['513-85-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_62064']; candidate_pubchem_cids=[262, 220010, 266597]; selected_pubchem_cids=[262]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 2,468 | bootstrap_labels | prefLabel | — | [{"@value":"butane-2,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Bootstrapped prefLabel from legacy name field |
| 2,469 | bootstrap_labels | name | butane-2,3-diol | — | Purged legacy name field to enforce prefLabel usage |
| 2,470 | bootstrap_labels | synonyms | ["butane-2,3-diol","2,3-butandiol","2,3-butyleneglycol","2,3-butylenglykol","butylenglykolgemisch-loesung","butylenglyk… | [] | Removed legacy synonyms field in favor of structured labels |
| 97,890 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 97,891 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 214,162 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,656 | normalize_name_case | prefLabel | [{"@value":"butane-2,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | [{"@value":"Butane-2,3-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) |
| 229,553 | 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) |
| 229,554 | enrich_references | skos_definition | — | [{"@value":"A butanediol in which hydroxylation is at C-2 and C-3.","@language":"en","provenance":{"prov:wasGeneratedBy… | Merged ChEBI/PubChem definitions into skos:definition |
| 229,555 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.283I","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['513-85-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_62064']; candidate_pubchem_cids=[262, 220010, 266597]; selected_pubchem_cids=[262]; 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 |
| 254,654 | chebi_altlabels | altLabel | [] | [{"@value":"2,3-Butanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | Added 7 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 264,552 | consensus_match | altLabel | [{"@value":"2,3-Butanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | [{"@value":"2,3-Butanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | group_key=butane-2,3-diol||dimension=Environmental > media=Air > strata=Unknown; cas=513-85-9; added Common Chemistry CAS names as altLabel: 1,2-Dimethyl-1,2-ethanediol; object_uuid=fo-23a92457b5de79de |
| 264,553 | consensus_match | cas_match_labels | — | {"513-85-9":"exactMatch"} | group_key=butane-2,3-diol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'513-85-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-23a92457b5de79de: {'513-85-9': 'exactMatch'} |
| 274,121 | 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-2,3-diol' |
| 280,537 | 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)C(C)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 329,942 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/50b1a53a-95ca-… | associations resolved on the elementary layer |
| 388,414 | 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 |
| 395,137 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260821T1554374006150000/2468 | prefLabel | ef:agent/bootstrap_labels | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v0 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v1 |
| ef:activity/change/20260821T1554374006150000/2469 | name | ef:agent/bootstrap_labels | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v1 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v2 |
| ef:activity/change/20260821T1554374006150000/2470 | synonyms | ef:agent/bootstrap_labels | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v2 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v3 |
| ef:activity/change/20260821T1554374006150000/97890 | context | ef:agent/default_context_mapping | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v3 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v4 |
| ef:activity/change/20260821T1554374006150000/97891 | context_iri | ef:agent/default_context_mapping | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v4 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v5 |
| ef:activity/change/20260821T1554374006150000/214162 | unit_iri | ef:agent/unit_normalization | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v5 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v6 |
| ef:activity/change/20260821T1554374006150000/221656 | prefLabel | ef:agent/normalize_name_case | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v6 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v7 |
| ef:activity/change/20260821T1554374006150000/229553 | properties | ef:agent/enrich_references | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v7 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v8 |
| ef:activity/change/20260821T1554374006150000/229554 | skos_definition | ef:agent/enrich_references | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v8 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v9 |
| ef:activity/change/20260821T1554374006150000/229555 | references | ef:agent/enrich_references | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v9 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v10 |
| ef:activity/change/20260821T1554374006150000/254654 | altLabel | ef:agent/chebi_altlabels | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v10 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v11 |
| ef:activity/change/20260821T1554374006150000/264552 | altLabel | ef:agent/consensus_match | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v11 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v12 |
| ef:activity/change/20260821T1554374006150000/264553 | cas_match_labels | ef:agent/consensus_match | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v12 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v13 |
| ef:activity/change/20260821T1554374006150000/274121 | properties | ef:agent/opsin_iupac | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v13 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v14 |
| ef:activity/change/20260821T1554374006150000/280537 | properties | ef:agent/rdkit_post_consensus | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v14 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v15 |
| ef:activity/change/20260821T1554374006150000/329942 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v15 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v16 |
| ef:activity/change/20260821T1554374006150000/388414 | properties | ef:agent/normalise_property_values | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v16 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v17 |
| ef:activity/change/20260821T1554374006150000/395137 | types | ef:agent/link_flows_to_their_substance | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v17 | ef:flow/50b1a53a-95ca-4ebb-a257-b15f96e21684/v18 |