Chlorambucil
Everything that changed this flow. Back to the flow
b3f136f7-43f3-4bee-ab83-fc1435b45248
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): 'CB 1348' (grade code), 'NCI 3088' (grade code), 'NSC 3088' (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=chlorambucil||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'305-03-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a591b843b5534cb7: {'305-03-3': '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 air > Emissions to air, unspecified (long-term) |
| 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 (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['305-03-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_28830']; candidate_pubchem_cids=[2708, 238870, 46705346]; selected_pubchem_cids=[2708]; 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 |
|---|---|---|---|---|---|
| 22,869 | bootstrap_labels | prefLabel | — | [{"@value":"chlorambucil","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | Bootstrapped prefLabel from legacy name field |
| 22,870 | bootstrap_labels | name | chlorambucil | — | Purged legacy name field to enforce prefLabel usage |
| 23,135 | bootstrap_labels | synonyms | [".gamma.-(p-bis(2-chloroethyl)aminophenyl)butyric acid",".gamma.-[p-Di(2-chloroethyl)aminophenyl]butyric acid",".gamma… | [] | Removed legacy synonyms field in favor of structured labels |
| 156,680 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 156,681 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 220,581 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,226 | normalize_name_case | prefLabel | [{"@value":"chlorambucil","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | [{"@value":"Chlorambucil","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 247,740 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 247,741 | enrich_references | skos_definition | — | [{"@value":"A monocarboxylic acid that is butanoic acid substituted at position 4 by a 4-[bis(2-chloroethyl)amino]pheny… | Merged ChEBI/PubChem definitions into skos:definition |
| 247,742 | enrich_references | references | [] | [{"@id":"drugcentral:588","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"c… | Added references with provenance; cas_numbers=['305-03-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_28830']; candidate_pubchem_cids=[2708, 238870, 46705346]; selected_pubchem_cids=[2708]; 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 |
| 254,249 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | rdkit_pre_consensus from 'C1=CC(=CC=C1CCCC(=O)O)N(CCCl)CCCl'; added: monoisotopic_mass |
| 257,279 | chebi_altlabels | altLabel | [] | [{"@value":"4-(p-bis(beta-chloroethyl)aminophenyl)butyric acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi… | Added 9 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 265,003 | consensus_match | altLabel | [{"@value":"4-(p-bis(beta-chloroethyl)aminophenyl)butyric acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi… | [{"@value":"4-(p-bis(beta-chloroethyl)aminophenyl)butyric acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi… | group_key=chlorambucil||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=305-03-3; added Common Chemistry CAS names as altLabel: 4-[4-[Bis(2-chloroethyl)amino]phenyl]butanoic acid, 4-[Bis(2-chloroethyl)amino]benzenebutanoic acid, Amboclorin, Benzenebutanoic acid, 4-[bis(2-chloroethyl)amino]-, Butyric acid, 4-[<em>p</em>-[bis(2-chloroethyl)amino]phenyl]-, CB 1348, Chloraminophene, Chlorbutin, Chlorobutine, Ecloril, Leukeran Tablets, Linfolizin, Linfolysin, Lympholysin, MeSH ID: D002699, NCI 3088, NSC 3088, γ-[<em>p</em>-Bis(2-chloroethyl)aminophenyl]butyric acid, γ-[<em>p</em>-Di(2-chloroethyl)aminophenyl]butyric acid; object_uuid=fo-a591b843b5534cb7 |
| 265,004 | consensus_match | cas_match_labels | — | {"305-03-3":"exactMatch"} | group_key=chlorambucil||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'305-03-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a591b843b5534cb7: {'305-03-3': 'exactMatch'} |
| 279,477 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-(p-bis(beta-chloroethyl)aminophenyl)butyric acid' |
| 286,354 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | rdkit_post_consensus from 'O=C(O)CCCc1ccc(N(CCCl)CCCl)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,697 | strip_catalogue_altlabels | altLabel | [{"@value":"4-(p-bis(beta-chloroethyl)aminophenyl)butyric acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi… | [{"@value":"4-(p-bis(beta-chloroethyl)aminophenyl)butyric acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi… | Removed 3 catalogue altLabel value(s): 'CB 1348' (grade code), 'NCI 3088' (grade code), 'NSC 3088' (registry code) |
| 359,365 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b3f136f7-43f3-… | associations resolved on the elementary layer |
| 393,871 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H19Cl2N… | typed the way the ontology types it |
| 403,077 | 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/20260822T0600486828500000/22869 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v0 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v1 |
| ef:activity/change/20260822T0600486828500000/22870 | name | ef:agent/bootstrap_labels | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v1 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v2 |
| ef:activity/change/20260822T0600486828500000/23135 | synonyms | ef:agent/bootstrap_labels | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v2 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v3 |
| ef:activity/change/20260822T0600486828500000/156680 | context | ef:agent/default_context_mapping | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v3 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v4 |
| ef:activity/change/20260822T0600486828500000/156681 | context_iri | ef:agent/default_context_mapping | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v4 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v5 |
| ef:activity/change/20260822T0600486828500000/220581 | unit_iri | ef:agent/unit_normalization | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v5 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v6 |
| ef:activity/change/20260822T0600486828500000/226226 | prefLabel | ef:agent/normalize_name_case | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v6 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v7 |
| ef:activity/change/20260822T0600486828500000/247740 | properties | ef:agent/enrich_references | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v7 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v8 |
| ef:activity/change/20260822T0600486828500000/247741 | skos_definition | ef:agent/enrich_references | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v8 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v9 |
| ef:activity/change/20260822T0600486828500000/247742 | references | ef:agent/enrich_references | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v9 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v10 |
| ef:activity/change/20260822T0600486828500000/254249 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v10 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v11 |
| ef:activity/change/20260822T0600486828500000/257279 | altLabel | ef:agent/chebi_altlabels | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v11 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v12 |
| ef:activity/change/20260822T0600486828500000/265003 | altLabel | ef:agent/consensus_match | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v12 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v13 |
| ef:activity/change/20260822T0600486828500000/265004 | cas_match_labels | ef:agent/consensus_match | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v13 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v14 |
| ef:activity/change/20260822T0600486828500000/279477 | properties | ef:agent/opsin_iupac | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v14 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v15 |
| ef:activity/change/20260822T0600486828500000/286354 | properties | ef:agent/rdkit_post_consensus | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v15 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v16 |
| ef:activity/change/20260822T0600486828500000/291697 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v16 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v17 |
| ef:activity/change/20260822T0600486828500000/359365 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v17 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v18 |
| ef:activity/change/20260822T0600486828500000/393871 | properties | ef:agent/normalise_property_values | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v18 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v19 |
| ef:activity/change/20260822T0600486828500000/403077 | types | ef:agent/link_flows_to_their_substance | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v19 | ef:flow/b3f136f7-43f3-4bee-ab83-fc1435b45248/v20 |