Peracetic Acid
Everything that changed this flow. Back to the flow
19bc2c69-44be-43c7-8613-10a141551aed
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 8 catalogue altLabel value(s): 'Agrosteril 110' (trade name), 'Oxigreen 010' (trade name), 'Percidin 535' (trade name), 'Proxitane 1507' (trade name), 'Proxitane 1512' (trade name), 'Proxitane 4002' (trade name), 'Tsunami 100' (trade name), 'Tsunami 200' (trade name) |
| 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=peraceticacid||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'79-21-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-52dc9a19403dceaa: {'79-21-0': '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 water > Emissions to sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['79-21-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_42530']; candidate_pubchem_cids=[6585, 18466526]; selected_pubchem_cids=[6585]; 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 |
|---|---|---|---|---|---|
| 16,358 | bootstrap_labels | prefLabel | — | [{"@value":"peracetic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | Bootstrapped prefLabel from legacy name field |
| 16,359 | bootstrap_labels | name | peracetic acid | — | Purged legacy name field to enforce prefLabel usage |
| 16,360 | bootstrap_labels | synonyms | ["AC1L1MUV","AC1Q1LDA","Acecide","Acecide (TN)","Acetic peroxide","Acetyl hydroperoxide","Acide peracetique","Acide per… | [] | Removed legacy synonyms field in favor of structured labels |
| 53,557 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 53,558 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 218,712 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,853 | normalize_name_case | prefLabel | [{"@value":"peracetic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | [{"@value":"Peracetic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,568 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 242,569 | enrich_references | skos_definition | — | [{"@value":"A peroxy acid that is acetic acid in which the OH group is substituted by a hydroperoxy group. It is a vers… | Merged ChEBI/PubChem definitions into skos:definition |
| 242,570 | enrich_references | references | [] | [{"@id":"agr:IND606966078","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['79-21-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_42530']; candidate_pubchem_cids=[6585, 18466526]; selected_pubchem_cids=[6585]; 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 |
| 252,760 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | rdkit_pre_consensus from 'CC(=O)OO'; added: monoisotopic_mass |
| 256,550 | chebi_altlabels | altLabel | [] | [{"@value":"Acecide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Added 15 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 270,505 | consensus_match | altLabel | [{"@value":"Acecide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"Acecide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | group_key=peraceticacid||dimension=Environmental > media=Water > water_body=Ocean; cas=79-21-0; added Common Chemistry CAS names as altLabel: Agrosteril 110, Agrosteril 110SL, CaiBingLing, EnviroSan, Hydroperoxide, acetyl, Incimaxx Aqua S, LCAP, MeSH ID: D010463, Oxigreen 010, Oxypel, Ozonit, PES 15/23, Paraclean, Peraclean 15, Peraclean 35, Peraclean Ocean, Perasafe, Percidin 535, Peresal, Perethanoic acid, Persan MP 2J, Proxitane 12A, Proxitane 15, Proxitane 1507, Proxitane 1512, Proxitane 5, Proxitane Alfa, Proxitane S, Redoxx 60, Steridial P, Steris 20, Synergize P 22, Tsunami, Tsunami 100, Tsunami 200; object_uuid=fo-52dc9a19403dceaa |
| 270,506 | consensus_match | cas_match_labels | — | {"79-21-0":"exactMatch"} | group_key=peraceticacid||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'79-21-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-52dc9a19403dceaa: {'79-21-0': 'exactMatch'} |
| 277,964 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Peracetic Acid' |
| 284,683 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | rdkit_post_consensus from 'CC(=O)OO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,584 | strip_catalogue_altlabels | altLabel | [{"@value":"Acecide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"Acecide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Removed 8 catalogue altLabel value(s): 'Agrosteril 110' (trade name), 'Oxigreen 010' (trade name), 'Percidin 535' (trade name), 'Proxitane 1507' (trade name), 'Proxitane 1512' (trade name), 'Proxitane 4002' (trade name), 'Tsunami 100' (trade name), 'Tsunami 200' (trade name) |
| 307,844 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/19bc2c69-44be-… | associations resolved on the elementary layer |
| 392,339 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4O3"],"… | typed the way the ontology types it |
| 400,745 | 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/20260920T1042228874600000/16358 | prefLabel | ef:agent/bootstrap_labels | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v0 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v1 |
| ef:activity/change/20260920T1042228874600000/16359 | name | ef:agent/bootstrap_labels | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v1 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v2 |
| ef:activity/change/20260920T1042228874600000/16360 | synonyms | ef:agent/bootstrap_labels | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v2 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v3 |
| ef:activity/change/20260920T1042228874600000/53557 | context | ef:agent/default_context_mapping | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v3 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v4 |
| ef:activity/change/20260920T1042228874600000/53558 | context_iri | ef:agent/default_context_mapping | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v4 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v5 |
| ef:activity/change/20260920T1042228874600000/218712 | unit_iri | ef:agent/unit_normalization | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v5 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v6 |
| ef:activity/change/20260920T1042228874600000/224853 | prefLabel | ef:agent/normalize_name_case | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v6 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v7 |
| ef:activity/change/20260920T1042228874600000/242568 | properties | ef:agent/enrich_references | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v7 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v8 |
| ef:activity/change/20260920T1042228874600000/242569 | skos_definition | ef:agent/enrich_references | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v8 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v9 |
| ef:activity/change/20260920T1042228874600000/242570 | references | ef:agent/enrich_references | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v9 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v10 |
| ef:activity/change/20260920T1042228874600000/252760 | properties | ef:agent/rdkit_pre_consensus | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v10 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v11 |
| ef:activity/change/20260920T1042228874600000/256550 | altLabel | ef:agent/chebi_altlabels | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v11 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v12 |
| ef:activity/change/20260920T1042228874600000/270505 | altLabel | ef:agent/consensus_match | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v12 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v13 |
| ef:activity/change/20260920T1042228874600000/270506 | cas_match_labels | ef:agent/consensus_match | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v13 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v14 |
| ef:activity/change/20260920T1042228874600000/277964 | properties | ef:agent/opsin_iupac | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v14 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v15 |
| ef:activity/change/20260920T1042228874600000/284683 | properties | ef:agent/rdkit_post_consensus | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v15 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v16 |
| ef:activity/change/20260920T1042228874600000/290584 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v16 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v17 |
| ef:activity/change/20260920T1042228874600000/307844 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v17 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v18 |
| ef:activity/change/20260920T1042228874600000/392339 | properties | ef:agent/normalise_property_values | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v18 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v19 |
| ef:activity/change/20260920T1042228874600000/400745 | types | ef:agent/link_flows_to_their_substance | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v19 | ef:flow/19bc2c69-44be-43c7-8613-10a141551aed/v20 |