Propane-1,3-diol
Everything that changed this flow. Back to the flow
25999321-a8d9-4996-aa08-2a73c7c758b2
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 65426' (registry code), 'P 0486' (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=propane-1,3-diol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'504-63-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-42351383debed6f0: {'504-63-2': '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=['504-63-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_16109']; candidate_pubchem_cids=[10442]; selected_pubchem_cids=[10442]; 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 |
|---|---|---|---|---|---|
| 4,880 | bootstrap_labels | prefLabel | — | [{"@value":"propane-1,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 4,881 | bootstrap_labels | name | propane-1,3-diol | — | Purged legacy name field to enforce prefLabel usage |
| 4,882 | bootstrap_labels | synonyms | [".beta.-Propylene glycol",".omega.-Propanediol","1,3-Dihydroxypropane","1,3-PROPANDIOL","1,3-PROPANEDIOL","1,3-Propyle… | [] | Removed legacy synonyms field in favor of structured labels |
| 61,468 | 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 |
| 61,469 | 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 |
| 214,969 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,219 | normalize_name_case | prefLabel | [{"@value":"propane-1,3-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Propane-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) |
| 231,867 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 231,868 | enrich_references | skos_definition | — | [{"@value":"The simplest member of the class of propane-1,3-diols, consisting of propane in which one hydrogen from eac… | Merged ChEBI/PubChem definitions into skos:definition |
| 231,869 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.606I","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['504-63-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_16109']; candidate_pubchem_cids=[10442]; selected_pubchem_cids=[10442]; 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 |
| 249,662 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | rdkit_pre_consensus from 'C(CO)CO'; added: monoisotopic_mass |
| 254,996 | chebi_altlabels | altLabel | [] | [{"@value":"(HOCH2)2CH2","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | Added 14 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 271,031 | consensus_match | altLabel | [{"@value":"(HOCH2)2CH2","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | [{"@value":"(HOCH2)2CH2","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | group_key=propane-1,3-diol||dimension=Environmental > media=Water > water_body=Unknown; cas=504-63-2; added Common Chemistry CAS names as altLabel: Activonol 3, Bio-PDO, NSC 65426, P 0486, PG, Propan-1,3-diol, Susterra, Zemea, Zemea Select Propanediol, Zemea propanediol, β-Propylene glycol, ω-Propanediol; object_uuid=fo-42351383debed6f0 |
| 271,032 | consensus_match | cas_match_labels | — | {"504-63-2":"exactMatch"} | group_key=propane-1,3-diol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'504-63-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-42351383debed6f0: {'504-63-2': 'exactMatch'} |
| 274,796 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Propane-1,3-diol' |
| 281,266 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | rdkit_post_consensus from 'OCCCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,260 | strip_catalogue_altlabels | altLabel | [{"@value":"(HOCH2)2CH2","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | [{"@value":"(HOCH2)2CH2","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | Removed 2 catalogue altLabel value(s): 'NSC 65426' (registry code), 'P 0486' (grade code) |
| 311,753 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/25999321-a8d9-… | associations resolved on the elementary layer |
| 389,105 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H8O2"],"… | typed the way the ontology types it |
| 396,119 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260821T1554374006150000/4880 | prefLabel | ef:agent/bootstrap_labels | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v0 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v1 |
| ef:activity/change/20260821T1554374006150000/4881 | name | ef:agent/bootstrap_labels | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v1 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v2 |
| ef:activity/change/20260821T1554374006150000/4882 | synonyms | ef:agent/bootstrap_labels | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v2 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v3 |
| ef:activity/change/20260821T1554374006150000/61468 | context | ef:agent/default_context_mapping | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v3 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v4 |
| ef:activity/change/20260821T1554374006150000/61469 | context_iri | ef:agent/default_context_mapping | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v4 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v5 |
| ef:activity/change/20260821T1554374006150000/214969 | unit_iri | ef:agent/unit_normalization | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v5 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v6 |
| ef:activity/change/20260821T1554374006150000/222219 | prefLabel | ef:agent/normalize_name_case | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v6 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v7 |
| ef:activity/change/20260821T1554374006150000/231867 | properties | ef:agent/enrich_references | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v7 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v8 |
| ef:activity/change/20260821T1554374006150000/231868 | skos_definition | ef:agent/enrich_references | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v8 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v9 |
| ef:activity/change/20260821T1554374006150000/231869 | references | ef:agent/enrich_references | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v9 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v10 |
| ef:activity/change/20260821T1554374006150000/249662 | properties | ef:agent/rdkit_pre_consensus | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v10 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v11 |
| ef:activity/change/20260821T1554374006150000/254996 | altLabel | ef:agent/chebi_altlabels | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v11 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v12 |
| ef:activity/change/20260821T1554374006150000/271031 | altLabel | ef:agent/consensus_match | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v12 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v13 |
| ef:activity/change/20260821T1554374006150000/271032 | cas_match_labels | ef:agent/consensus_match | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v13 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v14 |
| ef:activity/change/20260821T1554374006150000/274796 | properties | ef:agent/opsin_iupac | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v14 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v15 |
| ef:activity/change/20260821T1554374006150000/281266 | properties | ef:agent/rdkit_post_consensus | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v15 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v16 |
| ef:activity/change/20260821T1554374006150000/288260 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v16 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v17 |
| ef:activity/change/20260821T1554374006150000/311753 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v17 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v18 |
| ef:activity/change/20260821T1554374006150000/389105 | properties | ef:agent/normalise_property_values | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v18 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v19 |
| ef:activity/change/20260821T1554374006150000/396119 | types | ef:agent/link_flows_to_their_substance | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v19 | ef:flow/25999321-a8d9-4996-aa08-2a73c7c758b2/v20 |