2-acetoxybenzoic Acid
Everything that changed this flow. Back to the flow
494e5c9a-f310-4fd8-a39e-04a93e37fe6a
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 12 catalogue altLabel value(s): 'AC 5230' (grade code), 'Aspirin Protect 100' (trade name), 'Aspirin Protect 300' (trade name), 'IWN 11' (grade code), 'NSC 27223' (registry code), 'NSC 406186' (registry code), 'Rhodine 2312' (trade name), 'Rhodine 3040' (trade name), 'Rhodine 3118' (trade name), 'Rhodine 3220' (trade name), 'Rodine 3220' (trade name), 'SP 189' (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=2-acetoxybenzoicacid||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'50-78-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb4ad356fa7adf0c: {'50-78-2': '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=['50-78-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_15365']; candidate_pubchem_cids=[2244, 67252, 3434975, 12280114]; selected_pubchem_cids=[2244]; 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 |
|---|---|---|---|---|---|
| 19,150 | bootstrap_labels | prefLabel | — | [{"@value":"2-acetoxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Bootstrapped prefLabel from legacy name field |
| 19,151 | bootstrap_labels | name | 2-acetoxybenzoic acid | — | Purged legacy name field to enforce prefLabel usage |
| 19,152 | bootstrap_labels | synonyms | ["organic","o-acetylsalicylicacid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 84,850 | 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 |
| 84,851 | 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 |
| 219,586 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,456 | normalize_name_case | prefLabel | [{"@value":"2-acetoxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | [{"@value":"2-acetoxybenzoic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 245,011 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 245,012 | enrich_references | skos_definition | — | [{"@value":"A member of the class of benzoic acids that is salicylic acid in which the hydrogen that is attached to the… | Merged ChEBI/PubChem definitions into skos:definition |
| 245,013 | enrich_references | references | [] | [{"@id":"drugcentral:74","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"co… | Added references with provenance; cas_numbers=['50-78-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_15365']; candidate_pubchem_cids=[2244, 67252, 3434975, 12280114]; selected_pubchem_cids=[2244]; 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 |
| 253,459 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | rdkit_pre_consensus from 'CC(=O)OC1=CC=CC=C1C(=O)O'; added: monoisotopic_mass |
| 256,884 | chebi_altlabels | altLabel | [] | [{"@value":"2-(ACETYLOXY)BENZOIC ACID","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Added 18 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 260,484 | consensus_match | altLabel | [{"@value":"2-(ACETYLOXY)BENZOIC ACID","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"2-(ACETYLOXY)BENZOIC ACID","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | group_key=2-acetoxybenzoicacid||dimension=Environmental > media=Air > indoor=Unknown; cas=50-78-2; added Common Chemistry CAS names as altLabel: 2-Carboxyphenyl acetate, <em>o</em>-(Acetyloxy)benzoic acid, A.S.A. Empirin, AC 5230, Acenterine, Acesal, Acesan, Acetard, Aceticyl, Acetilum acidulatum, Acetisal, Acetophen, Acetosal, Acetosalic acid, Acetosalin, Acetylin, Acetylsal, Acetyonyl, Acetysal, Acimetten, Acisal, Acylpyrin, Adiro, Albyl E, Angettes 75, Anopyrin, Asaflow, Asagran, Asatard, Ascoden 30, Ascolong, Ascriptin, Aspalon, Aspergum, Aspirdrops, Aspirin Protect 100, Aspirin Protect 300, Aspirin-Direkt, Aspirina, Aspirina 03, Aspirine, Aspro, Aspro Clear, Aspropharm, Asteric, Astrix, Bayaspirin, Benaspir, Benzoic acid, 2-(acetyloxy)-, Bialpirina, Bialpirinia, Caprin, Cardioaspirin, Cardioaspirina, Cardiomagnyl, Claradin, Colfarit, Colsprin, Contrheuma Retard, Coraspin, Coricidin, Coricidin D, Crystar, Darvon Compound, Dolean pH 8, Dominal, Duramax, Durlaza, ECM, Ecopirin, Ecosprin, Ecotrin, Empirin, Endosprin, Endydol, Entericin, Enterophen, Enterosarine, Entrophen, Ewin, Extren, Gelprin, Globentyl, Globoid, Helicon, IWN 11, Idragin, Istopirin, Kapsazal, Lysoprin (pharmaceutical), Magnecyl, MeSH ID: D001241, Measurin, Medisyl, Melhoral, Micristin, Miniasal, Mycropyrin, NSC 27223, NSC 406186, Neuronika, Novid, Nu-seals, Persistin, Polopiryna, Rheumintabletten, Rhodine, Rhodine 2312, Rhodine 3040, Rhodine 3118, Rhodine 3220, Rhodine NC RP, Rhonal, Rivo, Rodine 3220, SP 189, Salacetin, Salcetogen, Saletin, Salospir, Salycylacetylsalicylic acid, Solpyron, Supac, Temperal, ThromboASS, Toldex, Triple-sal, Trombyl, Xaxa, Yasta, Zorprin, Zosprin; object_uuid=fo-bb4ad356fa7adf0c |
| 260,485 | consensus_match | cas_match_labels | — | {"50-78-2":"exactMatch"} | group_key=2-acetoxybenzoicacid||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'50-78-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb4ad356fa7adf0c: {'50-78-2': 'exactMatch'} |
| 278,687 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-acetoxybenzoic Acid' |
| 285,467 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | rdkit_post_consensus from 'CC(=O)Oc1ccccc1C(=O)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,129 | strip_catalogue_altlabels | altLabel | [{"@value":"2-(ACETYLOXY)BENZOIC ACID","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"2-(ACETYLOXY)BENZOIC ACID","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Removed 12 catalogue altLabel value(s): 'AC 5230' (grade code), 'Aspirin Protect 100' (trade name), 'Aspirin Protect 300' (trade name), 'IWN 11' (grade code), 'NSC 27223' (registry code), 'NSC 406186' (registry code), 'Rhodine 2312' (trade name), 'Rhodine 3040' (trade name), 'Rhodine 3118' (trade name), 'Rhodine 3220' (trade name), 'Rodine 3220' (trade name), 'SP 189' (grade code) |
| 323,460 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/494e5c9a-f310-… | associations resolved on the elementary layer |
| 393,056 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8O4"],"… | typed the way the ontology types it |
| 401,815 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 401,816 | link_flows_to_their_substance | roles | — | [{"@id":"http://purl.obolibrary.org/obo/CHEBI_33286","rdfs:label":"agrochemical","http://www.w3.org/2004/02/skos/core#d… | 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/20260820T0738569779880000/19150 | prefLabel | ef:agent/bootstrap_labels | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v0 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v1 |
| ef:activity/change/20260820T0738569779880000/19151 | name | ef:agent/bootstrap_labels | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v1 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v2 |
| ef:activity/change/20260820T0738569779880000/19152 | synonyms | ef:agent/bootstrap_labels | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v2 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v3 |
| ef:activity/change/20260820T0738569779880000/84850 | context | ef:agent/default_context_mapping | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v3 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v4 |
| ef:activity/change/20260820T0738569779880000/84851 | context_iri | ef:agent/default_context_mapping | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v4 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v5 |
| ef:activity/change/20260820T0738569779880000/219586 | unit_iri | ef:agent/unit_normalization | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v5 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v6 |
| ef:activity/change/20260820T0738569779880000/225456 | prefLabel | ef:agent/normalize_name_case | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v6 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v7 |
| ef:activity/change/20260820T0738569779880000/245011 | properties | ef:agent/enrich_references | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v7 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v8 |
| ef:activity/change/20260820T0738569779880000/245012 | skos_definition | ef:agent/enrich_references | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v8 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v9 |
| ef:activity/change/20260820T0738569779880000/245013 | references | ef:agent/enrich_references | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v9 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v10 |
| ef:activity/change/20260820T0738569779880000/253459 | properties | ef:agent/rdkit_pre_consensus | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v10 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v11 |
| ef:activity/change/20260820T0738569779880000/256884 | altLabel | ef:agent/chebi_altlabels | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v11 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v12 |
| ef:activity/change/20260820T0738569779880000/260484 | altLabel | ef:agent/consensus_match | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v12 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v13 |
| ef:activity/change/20260820T0738569779880000/260485 | cas_match_labels | ef:agent/consensus_match | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v13 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v14 |
| ef:activity/change/20260820T0738569779880000/278687 | properties | ef:agent/opsin_iupac | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v14 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v15 |
| ef:activity/change/20260820T0738569779880000/285467 | properties | ef:agent/rdkit_post_consensus | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v15 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v16 |
| ef:activity/change/20260820T0738569779880000/291129 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v16 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v17 |
| ef:activity/change/20260820T0738569779880000/323460 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v17 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v18 |
| ef:activity/change/20260820T0738569779880000/393056 | properties | ef:agent/normalise_property_values | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v18 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v19 |
| ef:activity/change/20260820T0738569779880000/401815 | types | ef:agent/link_flows_to_their_substance | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v19 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v20 |
| ef:activity/change/20260820T0738569779880000/401816 | roles | ef:agent/link_flows_to_their_substance | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v20 | ef:flow/494e5c9a-f310-4fd8-a39e-04a93e37fe6a/v21 |