Iopromide
Everything that changed this flow. Back to the flow
b4359fc3-0979-4a95-994c-973ff1f8410c
By field
14 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 4 catalogue altLabel value(s): 'SHL 414C' (grade code), 'Ultravist 300' (trade name), 'Ultravist 370' (trade name), 'ZK 35760' (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=iopromide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'73334-07-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-79526f713669ed1a: {'73334-07-3': '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 soil > Emissions to agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['73334-07-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_63578']; candidate_pubchem_cids=[3736, 49822759, 73416618]; selected_pubchem_cids=[3736]; 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 |
| roles | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 25 | bootstrap_labels | prefLabel | — | [{"@value":"iopromide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"cons… | Bootstrapped prefLabel from legacy name field |
| 26 | bootstrap_labels | name | iopromide | — | Purged legacy name field to enforce prefLabel usage |
| 27 | bootstrap_labels | synonyms | ["organic","iopromide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 156,840 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 156,841 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 213,346 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,105 | normalize_name_case | prefLabel | [{"@value":"iopromide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"cons… | [{"@value":"Iopromide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"cons… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,188 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 227,189 | enrich_references | skos_definition | — | [{"@value":"A dicarboxylic acid diamide that consists of N-methylisophthalamide bearing three iodo substituents at posi… | Merged ChEBI/PubChem definitions into skos:definition |
| 227,190 | enrich_references | references | [] | [{"@id":"drugcentral:1468","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['73334-07-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_63578']; candidate_pubchem_cids=[3736, 49822759, 73416618]; selected_pubchem_cids=[3736]; 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 |
| 248,313 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | rdkit_pre_consensus from 'CN(CC(CO)O)C(=O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)NC(=O)COC)I'; added: monoisotopic_mass |
| 254,391 | chebi_altlabels | altLabel | [] | [{"@value":"N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamide","@language":"en"… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 268,015 | consensus_match | altLabel | [{"@value":"N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamide","@language":"en"… | [{"@value":"N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamide","@language":"en"… | group_key=iopromide||dimension=Environmental > media=Water > water_body=Long-term; cas=73334-07-3; added Common Chemistry CAS names as altLabel: 1,3-Benzenedicarboxamide, <em>N</em>,<em>N</em>′-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(methoxyacetyl)amino]-<em>N</em>-methyl-, 1,3-Benzenedicarboxamide, <em>N</em><sup>1</sup>,<em>N</em><sup>3</sup>-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-<em>N</em><sup>1</sup>-methyl-, 1-<em>N</em>,3-<em>N</em>-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-3-<em>N</em>-methylbenzene-1,3-dicarboxamide, <em>N</em><sup>1</sup>,<em>N</em><sup>3</sup>-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-<em>N</em><sup>1</sup>-methyl-1,3-benzenedicarboxamide, SHL 414C, Ultravist 300, Ultravist 370, ZK 35760; object_uuid=fo-79526f713669ed1a |
| 268,016 | consensus_match | cas_match_labels | — | {"73334-07-3":"exactMatch"} | group_key=iopromide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'73334-07-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-79526f713669ed1a: {'73334-07-3': 'exactMatch'} |
| 273,457 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamide' |
| 279,807 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | rdkit_post_consensus from 'COCC(=O)Nc1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)N(C)CC(O)CO)c1I'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,273 | strip_catalogue_altlabels | altLabel | [{"@value":"N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamide","@language":"en"… | [{"@value":"N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamide","@language":"en"… | Removed 4 catalogue altLabel value(s): 'SHL 414C' (grade code), 'Ultravist 300' (trade name), 'Ultravist 370' (trade name), 'ZK 35760' (grade code) |
| 359,465 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b4359fc3-0979-… | associations resolved on the elementary layer |
| 387,738 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H24I3N3… | typed the way the ontology types it |
| 394,189 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 394,190 | link_flows_to_their_substance | roles | — | [{"@id":"http://purl.obolibrary.org/obo/CHEBI_78298","rdfs:label":"environmental contaminant","http://www.w3.org/2004/0… | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260820T0738569779880000/25 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v0 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v1 |
| ef:activity/change/20260820T0738569779880000/26 | name | ef:agent/bootstrap_labels | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v1 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v2 |
| ef:activity/change/20260820T0738569779880000/27 | synonyms | ef:agent/bootstrap_labels | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v2 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v3 |
| ef:activity/change/20260820T0738569779880000/156840 | context | ef:agent/default_context_mapping | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v3 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v4 |
| ef:activity/change/20260820T0738569779880000/156841 | context_iri | ef:agent/default_context_mapping | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v4 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v5 |
| ef:activity/change/20260820T0738569779880000/213346 | unit_iri | ef:agent/unit_normalization | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v5 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v6 |
| ef:activity/change/20260820T0738569779880000/221105 | prefLabel | ef:agent/normalize_name_case | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v6 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v7 |
| ef:activity/change/20260820T0738569779880000/227188 | properties | ef:agent/enrich_references | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v7 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v8 |
| ef:activity/change/20260820T0738569779880000/227189 | skos_definition | ef:agent/enrich_references | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v8 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v9 |
| ef:activity/change/20260820T0738569779880000/227190 | references | ef:agent/enrich_references | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v9 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v10 |
| ef:activity/change/20260820T0738569779880000/248313 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v10 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v11 |
| ef:activity/change/20260820T0738569779880000/254391 | altLabel | ef:agent/chebi_altlabels | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v11 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v12 |
| ef:activity/change/20260820T0738569779880000/268015 | altLabel | ef:agent/consensus_match | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v12 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v13 |
| ef:activity/change/20260820T0738569779880000/268016 | cas_match_labels | ef:agent/consensus_match | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v13 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v14 |
| ef:activity/change/20260820T0738569779880000/273457 | properties | ef:agent/opsin_iupac | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v14 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v15 |
| ef:activity/change/20260820T0738569779880000/279807 | properties | ef:agent/rdkit_post_consensus | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v15 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v16 |
| ef:activity/change/20260820T0738569779880000/287273 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v16 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v17 |
| ef:activity/change/20260820T0738569779880000/359465 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v17 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v18 |
| ef:activity/change/20260820T0738569779880000/387738 | properties | ef:agent/normalise_property_values | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v18 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v19 |
| ef:activity/change/20260820T0738569779880000/394189 | types | ef:agent/link_flows_to_their_substance | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v19 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v20 |
| ef:activity/change/20260820T0738569779880000/394190 | roles | ef:agent/link_flows_to_their_substance | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v20 | ef:flow/b4359fc3-0979-4a95-994c-973ff1f8410c/v21 |