2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide
Everything that changed this flow. Back to the flow
28f61637-9b25-4538-be07-f92b4b93ecab
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 | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['pubchem']; cas_sources={'518048-03-8': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3bce89704da1a1e7: {'518048-03-8': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['518048-03-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[887, 54721880, 132988708]; selected_pubchem_cids=[54721880]; 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 |
|---|---|---|---|---|---|
| 2,188 | bootstrap_labels | prefLabel | — | [{"@value":"2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide",… | Bootstrapped prefLabel from legacy name field |
| 2,189 | bootstrap_labels | name | 2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide | — | Purged legacy name field to enforce prefLabel usage |
| 2,190 | bootstrap_labels | synonyms | ["2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 63,390 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 63,391 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 214,067 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 229,282 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,283 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,284 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.104.812","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['518048-03-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[887, 54721880, 132988708]; selected_pubchem_cids=[54721880]; 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 |
| 248,924 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | rdkit_pre_consensus from 'CC(C)(C1=NC(=C(C(=O)N1C)O)C(=O)NCC2=CC=C(C=C2)F)N'; added: molecular_mass, monoisotopic_mass |
| 260,186 | consensus_match | altLabel | [] | [{"@value":"2-(1-Amino-1-methylethyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid 4-fluorobenzylam… | group_key=2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=518048-03-8; added Common Chemistry CAS names as altLabel: 2-(1-Amino-1-methylethyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid 4-fluorobenzylamide, 2-(1-Amino-1-methylethyl)-<em>N</em>-[(4-fluorophenyl)methyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-4-pyrimidinecarboxamide, 2-(2-Aminopropan-2-yl)-<em>N</em>-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide, 2-(2-Aminopropan-2-yl)-<em>N</em>-[(4-fluorophenyl)methyl]-5-hydroxy-1-methyl-6-oxopyrimidine-4-carboxamide, 4-Pyrimidinecarboxamide, 2-(1-amino-1-methylethyl)-<em>N</em>-[(4-fluorophenyl)methyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-; object_uuid=fo-3bce89704da1a1e7 |
| 260,187 | consensus_match | cas_match_labels | — | {"518048-03-8":"exactMatch"} | group_key=2-(1-amino-1-methylethyl)-n-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['pubchem']; cas_sources={'518048-03-8': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3bce89704da1a1e7: {'518048-03-8': 'exactMatch'} |
| 274,044 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-(1-Amino-1-methylethyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid 4-fluorobenzylamide' |
| 280,447 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | rdkit_post_consensus from 'Cn1c(C(C)(C)N)nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,076 | dedupe_altlabels | altLabel | [{"@value":"2-(1-Amino-1-methylethyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid 4-fluorobenzylam… | [{"@value":"2-(1-Amino-1-methylethyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid 4-fluorobenzylam… | Deduplicated altLabel values and removed entries matching prefLabel |
| 312,706 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/28f61637-9b25-… | associations resolved on the elementary layer |
| 388,328 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H19FN4O… | typed the way the ontology types it |
| 395,014 | 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/20260821T0609040591070000/2188 | prefLabel | ef:agent/bootstrap_labels | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v0 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v1 |
| ef:activity/change/20260821T0609040591070000/2189 | name | ef:agent/bootstrap_labels | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v1 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v2 |
| ef:activity/change/20260821T0609040591070000/2190 | synonyms | ef:agent/bootstrap_labels | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v2 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v3 |
| ef:activity/change/20260821T0609040591070000/63390 | context | ef:agent/default_context_mapping | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v3 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v4 |
| ef:activity/change/20260821T0609040591070000/63391 | context_iri | ef:agent/default_context_mapping | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v4 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v5 |
| ef:activity/change/20260821T0609040591070000/214067 | unit_iri | ef:agent/unit_normalization | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v5 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v6 |
| ef:activity/change/20260821T0609040591070000/229282 | properties | ef:agent/enrich_references | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v6 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v7 |
| ef:activity/change/20260821T0609040591070000/229283 | skos_definition | ef:agent/enrich_references | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v7 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v8 |
| ef:activity/change/20260821T0609040591070000/229284 | references | ef:agent/enrich_references | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v8 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v9 |
| ef:activity/change/20260821T0609040591070000/248924 | properties | ef:agent/rdkit_pre_consensus | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v9 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v10 |
| ef:activity/change/20260821T0609040591070000/260186 | altLabel | ef:agent/consensus_match | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v10 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v11 |
| ef:activity/change/20260821T0609040591070000/260187 | cas_match_labels | ef:agent/consensus_match | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v11 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v12 |
| ef:activity/change/20260821T0609040591070000/274044 | properties | ef:agent/opsin_iupac | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v12 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v13 |
| ef:activity/change/20260821T0609040591070000/280447 | properties | ef:agent/rdkit_post_consensus | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v13 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v14 |
| ef:activity/change/20260821T0609040591070000/292076 | altLabel | ef:agent/dedupe_altlabels | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v14 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v15 |
| ef:activity/change/20260821T0609040591070000/312706 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v15 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v16 |
| ef:activity/change/20260821T0609040591070000/388328 | properties | ef:agent/normalise_property_values | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v16 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v17 |
| ef:activity/change/20260821T0609040591070000/395014 | types | ef:agent/link_flows_to_their_substance | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v17 | ef:flow/28f61637-9b25-4538-be07-f92b4b93ecab/v18 |