Methyl N-benzoyl-N-(3-chloro-4-fluorophenyl)-DL-alaninate
Everything that changed this flow. Back to the flow
b1bc07e6-0998-4fd8-bc7a-a26cb649f839
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| prefLabel | 3 | bootstrap_labels, normalize_name_case, substance_label_v1 | the substance's name: Methyl N-benzoyl-N-(3-chloro-4-fluorophenyl)-DL-alaninate |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'WL 29761' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=methyln-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'52756-25-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f3bc62a7a3691f3a: {'52756-25-9': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['52756-25-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[40521, 114135]; selected_pubchem_cids=[40521]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 24,712 | bootstrap_labels | prefLabel | — | [{"@value":"methyl n-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate","@language":"en","source":{"prov:wasGeneratedBy"… | Bootstrapped prefLabel from legacy name field |
| 24,713 | bootstrap_labels | name | methyl n-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate | — | Purged legacy name field to enforce prefLabel usage |
| 24,714 | bootstrap_labels | synonyms | ["methyln-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate","methyl2-[n-(3-chloro-4-fluorophenyl)-1-phenylformamido]pro… | [] | Removed legacy synonyms field in favor of structured labels |
| 155,506 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 155,507 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 213,657 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,484 | normalize_name_case | prefLabel | [{"@value":"methyl n-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate","@language":"en","source":{"prov:wasGeneratedBy"… | [{"@value":"Methyl N-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate","@language":"en","source":{"prov:wasGeneratedBy"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,087 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,088 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,089 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J10.175C","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['52756-25-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[40521, 114135]; selected_pubchem_cids=[40521]; 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 |
| 248,581 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | rdkit_pre_consensus from 'CC(C(=O)OC)N(C1=CC(=C(C=C1)F)Cl)C(=O)C2=CC=CC=C2'; added: molecular_mass, monoisotopic_mass |
| 268,913 | consensus_match | altLabel | [] | [{"@value":"<span class=\"text-smallcaps\">DL</span>-<em>N</em>-Benzoyl-<em>N</em>-(3-chloro-4-fluorophenyl)alanine met… | group_key=methyln-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate||dimension=Environmental > media=Water > water_body=Unknown; cas=52756-25-9; added Common Chemistry CAS names as altLabel: <span class="text-smallcaps">DL</span>-<em>N</em>-Benzoyl-<em>N</em>-(3-chloro-4-fluorophenyl)alanine methyl ester, <span class="text-smallcaps">DL</span>-Alanine, <em>N</em>-benzoyl-<em>N</em>-(3-chloro-4-fluorophenyl)-, methyl ester, Alanine, <em>N</em>-benzoyl-<em>N</em>-(3-chloro-4-fluorophenyl)-, methyl ester, Flamprop-methyl, Flufenprop-methyl, Mataven, Methyl 2-[benzoyl(3-chloro-4-fluorophenyl)amino]propionate, Super-Suffix, WL 29761; object_uuid=fo-f3bc62a7a3691f3a |
| 268,914 | consensus_match | cas_match_labels | — | {"52756-25-9":"exactMatch"} | group_key=methyln-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'52756-25-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f3bc62a7a3691f3a: {'52756-25-9': 'exactMatch'} |
| 279,690 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'DL-N-Benzoyl-N-(3-chloro-4-fluorophenyl)alanine methyl ester' |
| 286,579 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | rdkit_post_consensus from 'COC(=O)C(C)N(C(=O)c1ccccc1)c1ccc(F)c(Cl)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,465 | strip_catalogue_altlabels | altLabel | [{"@value":"<span class=\"text-smallcaps\">DL</span>-<em>N</em>-Benzoyl-<em>N</em>-(3-chloro-4-fluorophenyl)alanine met… | [{"@value":"DL-N-Benzoyl-N-(3-chloro-4-fluorophenyl)alanine methyl ester","@language":"en","source":{"prov:wasGenerated… | Removed 1 catalogue altLabel value(s): 'WL 29761' (grade code) |
| 358,797 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b1bc07e6-0998-… | associations resolved on the elementary layer |
| 394,094 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | typed the way the ontology types it |
| 394,564 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 403,501 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H15ClFN… | the substance's answer, copied onto its flow |
| 404,288 | substance_label_v1 | prefLabel | [{"@value":"Methyl N-benzoyl-n-(3-chloro-4-fluorophenyl)-dl-alaninate","@language":"en","source":{"prov:wasGeneratedBy"… | [{"@value":"Methyl N-benzoyl-N-(3-chloro-4-fluorophenyl)-DL-alaninate","@language":"en","@lang":"en","source":{"prov:wa… | the substance's name: Methyl N-benzoyl-N-(3-chloro-4-fluorophenyl)-DL-alaninate |
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/20260820T1416470405690000/24712 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v0 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v1 |
| ef:activity/change/20260820T1416470405690000/24713 | name | ef:agent/bootstrap_labels | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v1 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v2 |
| ef:activity/change/20260820T1416470405690000/24714 | synonyms | ef:agent/bootstrap_labels | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v2 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v3 |
| ef:activity/change/20260820T1416470405690000/155506 | context | ef:agent/default_context_mapping | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v3 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v4 |
| ef:activity/change/20260820T1416470405690000/155507 | context_iri | ef:agent/default_context_mapping | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v4 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v5 |
| ef:activity/change/20260820T1416470405690000/213657 | unit_iri | ef:agent/unit_normalization | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v5 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v6 |
| ef:activity/change/20260820T1416470405690000/226484 | prefLabel | ef:agent/normalize_name_case | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v6 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v7 |
| ef:activity/change/20260820T1416470405690000/228087 | properties | ef:agent/enrich_references | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v7 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v8 |
| ef:activity/change/20260820T1416470405690000/228088 | skos_definition | ef:agent/enrich_references | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v8 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v9 |
| ef:activity/change/20260820T1416470405690000/228089 | references | ef:agent/enrich_references | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v9 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v10 |
| ef:activity/change/20260820T1416470405690000/248581 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v10 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v11 |
| ef:activity/change/20260820T1416470405690000/268913 | altLabel | ef:agent/consensus_match | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v11 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v12 |
| ef:activity/change/20260820T1416470405690000/268914 | cas_match_labels | ef:agent/consensus_match | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v12 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v13 |
| ef:activity/change/20260820T1416470405690000/279690 | properties | ef:agent/opsin_iupac | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v13 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v14 |
| ef:activity/change/20260820T1416470405690000/286579 | properties | ef:agent/rdkit_post_consensus | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v14 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v15 |
| ef:activity/change/20260820T1416470405690000/287465 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v15 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v16 |
| ef:activity/change/20260820T1416470405690000/358797 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v16 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v17 |
| ef:activity/change/20260820T1416470405690000/394094 | properties | ef:agent/normalise_property_values | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v17 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v18 |
| ef:activity/change/20260820T1416470405690000/394564 | types | ef:agent/link_flows_to_their_substance | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v18 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v19 |
| ef:activity/change/20260820T1416470405690000/403501 | properties | ef:agent/link_flows_to_their_substance | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v19 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v20 |
| ef:activity/change/20260820T1416470405690000/404288 | prefLabel | ef:agent/substance_label_v1 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v20 | ef:flow/b1bc07e6-0998-4fd8-bc7a-a26cb649f839/v21 |