Isophthalic Acid
Everything that changed this flow. Back to the flow
c3dff7c1-6175-4cb0-8fab-7783c9bab678
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 3 catalogue altLabel value(s): 'HA 20' (grade code), 'HA 20 (acid)' (grade code), 'NSC 15310' (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=isophthalicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-91-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-57e28a10f7ca5b7d: {'121-91-5': '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=['121-91-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_30802']; candidate_pubchem_cids=[8496, 5461079, 23461093]; selected_pubchem_cids=[8496]; 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 |
|---|---|---|---|---|---|
| 5,115 | bootstrap_labels | prefLabel | — | [{"@value":"isophthalic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 5,116 | bootstrap_labels | name | isophthalic acid | — | Purged legacy name field to enforce prefLabel usage |
| 5,117 | bootstrap_labels | synonyms | ["organic","isophthalicacid","agicpia","fomrezseries","ipa","pia","witcobondseries"] | [] | Removed legacy synonyms field in favor of structured labels |
| 165,806 | 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 |
| 165,807 | 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 |
| 215,048 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,275 | normalize_name_case | prefLabel | [{"@value":"isophthalic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Isophthalic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,097 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,098 | enrich_references | skos_definition | — | [{"@value":"A benzenedicarboxylic acid that is benzene substituted by carboxy groups at position 1 and 3. One of three… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,099 | enrich_references | references | [] | [{"@id":"gmelin:27618","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"cons… | Added references with provenance; cas_numbers=['121-91-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_30802']; candidate_pubchem_cids=[8496, 5461079, 23461093]; selected_pubchem_cids=[8496]; 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 |
| 249,726 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)C(=O)O)C(=O)O'; added: monoisotopic_mass |
| 255,031 | chebi_altlabels | altLabel | [] | [{"@value":"IPA","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensus-f… | Added 4 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 268,154 | consensus_match | altLabel | [{"@value":"IPA","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensus-f… | [{"@value":"IPA","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensus-f… | group_key=isophthalicacid||dimension=Environmental > media=Water > water_body=Unknown; cas=121-91-5; added Common Chemistry CAS names as altLabel: 1,3-Benzenedicarboxylic acid, 1,3-Phenylenedicarboxylic acid, 3-Carboxybenzoic acid, <em>m</em>-Carboxybenzoic acid, <em>m</em>-Dicarboxybenzene, <em>m</em>-Phthalic acid, HA 20, HA 20 (acid), Isoterephthalic acid, NSC 15310; object_uuid=fo-57e28a10f7ca5b7d |
| 268,155 | consensus_match | cas_match_labels | — | {"121-91-5":"exactMatch"} | group_key=isophthalicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-91-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-57e28a10f7ca5b7d: {'121-91-5': 'exactMatch'} |
| 274,866 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Isophthalic Acid' |
| 281,339 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | rdkit_post_consensus from 'O=C(O)c1cccc(C(=O)O)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,304 | strip_catalogue_altlabels | altLabel | [{"@value":"IPA","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensus-f… | [{"@value":"IPA","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensus-f… | Removed 3 catalogue altLabel value(s): 'HA 20' (grade code), 'HA 20 (acid)' (grade code), 'NSC 15310' (registry code) |
| 363,929 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c3dff7c1-6175-… | associations resolved on the elementary layer |
| 389,171 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O4"],"… | typed the way the ontology types it |
| 396,213 | 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/20260822T0600486828500000/5115 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v0 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v1 |
| ef:activity/change/20260822T0600486828500000/5116 | name | ef:agent/bootstrap_labels | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v1 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v2 |
| ef:activity/change/20260822T0600486828500000/5117 | synonyms | ef:agent/bootstrap_labels | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v2 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v3 |
| ef:activity/change/20260822T0600486828500000/165806 | context | ef:agent/default_context_mapping | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v3 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v4 |
| ef:activity/change/20260822T0600486828500000/165807 | context_iri | ef:agent/default_context_mapping | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v4 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v5 |
| ef:activity/change/20260822T0600486828500000/215048 | unit_iri | ef:agent/unit_normalization | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v5 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v6 |
| ef:activity/change/20260822T0600486828500000/222275 | prefLabel | ef:agent/normalize_name_case | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v6 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v7 |
| ef:activity/change/20260822T0600486828500000/232097 | properties | ef:agent/enrich_references | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v7 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v8 |
| ef:activity/change/20260822T0600486828500000/232098 | skos_definition | ef:agent/enrich_references | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v8 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v9 |
| ef:activity/change/20260822T0600486828500000/232099 | references | ef:agent/enrich_references | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v9 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v10 |
| ef:activity/change/20260822T0600486828500000/249726 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v10 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v11 |
| ef:activity/change/20260822T0600486828500000/255031 | altLabel | ef:agent/chebi_altlabels | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v11 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v12 |
| ef:activity/change/20260822T0600486828500000/268154 | altLabel | ef:agent/consensus_match | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v12 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v13 |
| ef:activity/change/20260822T0600486828500000/268155 | cas_match_labels | ef:agent/consensus_match | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v13 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v14 |
| ef:activity/change/20260822T0600486828500000/274866 | properties | ef:agent/opsin_iupac | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v14 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v15 |
| ef:activity/change/20260822T0600486828500000/281339 | properties | ef:agent/rdkit_post_consensus | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v15 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v16 |
| ef:activity/change/20260822T0600486828500000/288304 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v16 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v17 |
| ef:activity/change/20260822T0600486828500000/363929 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v17 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v18 |
| ef:activity/change/20260822T0600486828500000/389171 | properties | ef:agent/normalise_property_values | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v18 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v19 |
| ef:activity/change/20260822T0600486828500000/396213 | types | ef:agent/link_flows_to_their_substance | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v19 | ef:flow/c3dff7c1-6175-4cb0-8fab-7783c9bab678/v20 |