Hexyl 2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate
Everything that changed this flow. Back to the flow
fec86fec-8ac2-4b19-bfd8-b717eebe707c
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 |
| 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=hexyl2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'pubchem']; cas_sources={'302776-68-7': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b38e65f0cc8bec02: {'302776-68-7': '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=['302776-68-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_136006']; candidate_pubchem_cids=[10111431, 16736547]; selected_pubchem_cids=[10111431]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 6,636 | bootstrap_labels | prefLabel | — | [{"@value":"hexyl 2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate","@language":"en","source":{"prov:wasGeneratedBy":… | Bootstrapped prefLabel from legacy name field |
| 6,637 | bootstrap_labels | name | hexyl 2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate | — | Purged legacy name field to enforce prefLabel usage |
| 6,638 | bootstrap_labels | synonyms | ["organic","hexyl2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate","uvinulaplus"] | [] | Removed legacy synonyms field in favor of structured labels |
| 212,604 | 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 |
| 212,605 | 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 |
| 215,555 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,613 | normalize_name_case | prefLabel | [{"@value":"hexyl 2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate","@language":"en","source":{"prov:wasGeneratedBy":… | [{"@value":"Hexyl 2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate","@language":"en","source":{"prov:wasGeneratedBy":… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,548 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 233,549 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,550 | enrich_references | references | [] | [{"@id":"drugcentral:4602","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['302776-68-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_136006']; candidate_pubchem_cids=[10111431, 16736547]; selected_pubchem_cids=[10111431]; 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 |
| 250,152 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | rdkit_pre_consensus from 'CCCCCCOC(=O)C1=CC=CC=C1C(=O)C2=C(C=C(C=C2)N(CC)CC)O'; added: monoisotopic_mass |
| 267,713 | consensus_match | altLabel | [] | [{"@value":"2-(4′-Diethylamino-2′-hydroxybenzoyl)benzoic acid hexyl ester","@language":"en","source":{"prov:wasGenerate… | group_key=hexyl2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate||dimension=Environmental > media=Water > water_body=Long-term; cas=302776-68-7; added Common Chemistry CAS names as altLabel: 2-(4′-Diethylamino-2′-hydroxybenzoyl)benzoic acid hexyl ester, <em>n</em>-Hexyl 2-(4-diethylamino-2-hydroxybenzoyl)benzoate, Benzoic acid, 2-[4-(diethylamino)-2-hydroxybenzoyl]-, hexyl ester, Hexyl 2-[4-(diethylamino)-2-hydroxybenzoyl]benzoate, Uvinar A PLUS GRRANULAR, Uvinul A, Uvinul A Plus, Uvinul A Plus Granular, Uvinul A+; object_uuid=fo-b38e65f0cc8bec02 |
| 267,714 | consensus_match | cas_match_labels | — | {"302776-68-7":"exactMatch"} | group_key=hexyl2-(1-(diethylaminohydroxyphenyl)methanoyl)benzoate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'pubchem']; cas_sources={'302776-68-7': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b38e65f0cc8bec02: {'302776-68-7': 'exactMatch'} |
| 275,289 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-(4′-Diethylamino-2′-hydroxybenzoyl)benzoic acid hexyl ester' |
| 281,796 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | rdkit_post_consensus from 'CCCCCCOC(=O)c1ccccc1C(=O)c1ccc(N(CC)CC)cc1O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,322 | dedupe_altlabels | altLabel | [{"@value":"2-(4′-Diethylamino-2′-hydroxybenzoyl)benzoic acid hexyl ester","@language":"en","source":{"prov:wasGenerate… | [{"@value":"2-(4′-Diethylamino-2′-hydroxybenzoyl)benzoic acid hexyl ester","@language":"en","source":{"prov:wasGenerate… | Deduplicated altLabel values and removed entries matching prefLabel |
| 387,345 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fec86fec-8ac2-… | associations resolved on the elementary layer |
| 389,592 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C24H31NO4"… | typed the way the ontology types it |
| 396,811 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260822T0600486828500000/6636 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v0 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v1 |
| ef:activity/change/20260822T0600486828500000/6637 | name | ef:agent/bootstrap_labels | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v1 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v2 |
| ef:activity/change/20260822T0600486828500000/6638 | synonyms | ef:agent/bootstrap_labels | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v2 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v3 |
| ef:activity/change/20260822T0600486828500000/212604 | context | ef:agent/default_context_mapping | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v3 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v4 |
| ef:activity/change/20260822T0600486828500000/212605 | context_iri | ef:agent/default_context_mapping | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v4 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v5 |
| ef:activity/change/20260822T0600486828500000/215555 | unit_iri | ef:agent/unit_normalization | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v5 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v6 |
| ef:activity/change/20260822T0600486828500000/222613 | prefLabel | ef:agent/normalize_name_case | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v6 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v7 |
| ef:activity/change/20260822T0600486828500000/233548 | properties | ef:agent/enrich_references | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v7 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v8 |
| ef:activity/change/20260822T0600486828500000/233549 | skos_definition | ef:agent/enrich_references | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v8 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v9 |
| ef:activity/change/20260822T0600486828500000/233550 | references | ef:agent/enrich_references | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v9 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v10 |
| ef:activity/change/20260822T0600486828500000/250152 | properties | ef:agent/rdkit_pre_consensus | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v10 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v11 |
| ef:activity/change/20260822T0600486828500000/267713 | altLabel | ef:agent/consensus_match | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v11 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v12 |
| ef:activity/change/20260822T0600486828500000/267714 | cas_match_labels | ef:agent/consensus_match | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v12 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v13 |
| ef:activity/change/20260822T0600486828500000/275289 | properties | ef:agent/opsin_iupac | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v13 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v14 |
| ef:activity/change/20260822T0600486828500000/281796 | properties | ef:agent/rdkit_post_consensus | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v14 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v15 |
| ef:activity/change/20260822T0600486828500000/292322 | altLabel | ef:agent/dedupe_altlabels | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v15 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v16 |
| ef:activity/change/20260822T0600486828500000/387345 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v16 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v17 |
| ef:activity/change/20260822T0600486828500000/389592 | properties | ef:agent/normalise_property_values | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v17 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v18 |
| ef:activity/change/20260822T0600486828500000/396811 | types | ef:agent/link_flows_to_their_substance | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v18 | ef:flow/fec86fec-8ac2-4b19-bfd8-b717eebe707c/v19 |