Ethylenediaminetetraacetic acid
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-8cd8-0050c2490048
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 8 catalogue altLabel value(s): 'Chelest 110' (trade name), 'Chemcolox 340' (trade name), 'ICRF 185' (grade code), 'NSC 97243' (registry code), 'NSC 97404' (registry code), 'OM 002' (grade code), 'PM 17' (grade code), 'YD 30' (grade code) |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=60-00-4; cc_chebi_agreed_name='Ethylenediaminetetraacetic acid'; object_uuid=fo-2869e10c2f888bcb |
| cas_match_labels | 1 | consensus_match | group_key=edta||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory']; cas_sources={'60-00-4': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-2869e10c2f888bcb: {'60-00-4': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, 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=['60-00-4']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_4735']; candidate_pubchem_cids=[3077, 6049, 6144, 5232305, 18185437, 22141944]; selected_pubchem_cids=[6049]; 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 |
|---|---|---|---|---|---|
| 7,335 | bootstrap_labels | prefLabel | — | [{"@value":"EDTA","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"brightway… | Bootstrapped prefLabel from legacy name field |
| 7,336 | bootstrap_labels | name | EDTA | — | Purged legacy name field to enforce prefLabel usage |
| 7,337 | bootstrap_labels | synonyms | ["(Ethylenedinitrilo)tetraacetic acid","(Ethylenedinitrilo)tetraacetic acid, disodium salt","(ethane-1,2-diyldinitrilo)… | [] | Removed legacy synonyms field in favor of structured labels |
| 87,457 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 87,458 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 215,790 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 234,216 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 234,217 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 234,218 | enrich_references | references | [] | [{"@id":"drugcentral:987","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"b… | Added references with provenance; cas_numbers=['60-00-4']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_4735']; candidate_pubchem_cids=[3077, 6049, 6144, 5232305, 18185437, 22141944]; selected_pubchem_cids=[6049]; 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 |
| 250,349 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | rdkit_pre_consensus from 'C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O'; added: monoisotopic_mass |
| 255,342 | chebi_altlabels | altLabel | [] | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | Added 19 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 266,674 | consensus_match | prefLabel | [{"@value":"EDTA","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"brightway… | [{"@value":"Ethylenediaminetetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | cas=60-00-4; cc_chebi_agreed_name='Ethylenediaminetetraacetic acid'; object_uuid=fo-2869e10c2f888bcb |
| 266,675 | consensus_match | altLabel | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | cas=60-00-4; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-2869e10c2f888bcb |
| 266,678 | consensus_match | altLabel | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | group_key=edta||dimension=Environmental > media=Water > water_body=Unknown; cas=60-00-4; added Common Chemistry CAS names as altLabel: 2,2′,2′′,2′′′-(ethane-1,2-diylbis(azanetriyl))tetraacetic acid, 3,6-Diazaoctanedioic acid, 3,6-bis(carboxymethyl)-, <em>N</em>,<em>N</em>′-1,2-Ethanediylbis[<em>N</em>-(carboxymethyl)glycine], Acetic acid, (ethylenedinitrilo)tetra-, Acetic acid, 2,2′,2′′,2′′′-(1,2-ethanediyldinitrilo)tetrakis-, Acroma DH 700, Celon A, Celon ATH, Cheelox, Chelest 110, Chelest 3A, Chelest 40, Chelest A, Chemcolox 340, Circuposit 3350M1, Clewat 3K, Clewat TAA, Clewat TTA, Complexon II, Disolvin NA 2, Disolvin NA 2-S, Dissolvine E, Dissolvine NA-X, Dissolvine Z, Dotite 4H, EC, Endrate, Ethylene-<em>N</em>,<em>N</em>′-biscarboxymethyl-<em>N</em>,<em>N</em>′-diglycine, Ethylenediamine-<em>N</em>,<em>N</em>,<em>N</em>′,<em>N</em>′-tetraacetic acid, Ethylenediaminetetraaacetic acid, Ethylenediaminetetraacetate, Gluma Cleanser, Glycine, <em>N</em>,<em>N</em>′-1,2-ethanediylbis[<em>N</em>-(carboxymethyl)-, Havidote, ICRF 185, Kurewat-N, Metaquest A, NSC 97243, NSC 97404, Nervanaid B acid, Nullapon B acid, Nullapon BF acid, OM 002, PM 17, Perma Kleer 50 acid, PrefGel, Quastal Special, Sequestrene AA, Sequestrene K 4, Sequestric acid, Sequestrol, Techrun DO, Titriplex, Titriplex II, Trilon BS, Trilon BW, Versene, WS, WS (chelating agent), YD 30, Zonon AO, [[2-(Bis-carboxymethyl-amino)-ethyl]-carboxymethyl-amino]-acetic acid; object_uuid=fo-2869e10c2f888bcb |
| 266,680 | consensus_match | cas_match_labels | — | {"60-00-4":"exactMatch"} | group_key=edta||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory']; cas_sources={'60-00-4': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-2869e10c2f888bcb: {'60-00-4': 'exactMatch'} |
| 275,505 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Ethylenediaminetetraacetic acid' |
| 282,025 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | rdkit_post_consensus from 'O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,782 | strip_catalogue_altlabels | altLabel | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | [{"@value":"(ethane-1,2-diyldinitrilo)tetraacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabe… | Removed 8 catalogue altLabel value(s): 'Chelest 110' (trade name), 'Chemcolox 340' (trade name), 'ICRF 185' (grade code), 'NSC 97243' (registry code), 'NSC 97404' (registry code), 'OM 002' (grade code), 'PM 17' (grade code), 'YD 30' (grade code) |
| 324,783 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 389,842 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H16N2O8… | typed the way the ontology types it |
| 397,159 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20261019T0712047113160000/7335 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v1 |
| ef:activity/change/20261019T0712047113160000/7336 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v2 |
| ef:activity/change/20261019T0712047113160000/7337 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v3 |
| ef:activity/change/20261019T0712047113160000/87457 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v4 |
| ef:activity/change/20261019T0712047113160000/87458 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v5 |
| ef:activity/change/20261019T0712047113160000/215790 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v6 |
| ef:activity/change/20261019T0712047113160000/234216 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v7 |
| ef:activity/change/20261019T0712047113160000/234217 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v8 |
| ef:activity/change/20261019T0712047113160000/234218 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v9 |
| ef:activity/change/20261019T0712047113160000/250349 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v10 |
| ef:activity/change/20261019T0712047113160000/255342 | altLabel | ef:agent/chebi_altlabels | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v11 |
| ef:activity/change/20261019T0712047113160000/266674 | prefLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v12 |
| ef:activity/change/20261019T0712047113160000/266675 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v13 |
| ef:activity/change/20261019T0712047113160000/266678 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v14 |
| ef:activity/change/20261019T0712047113160000/266680 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v15 |
| ef:activity/change/20261019T0712047113160000/275505 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v16 |
| ef:activity/change/20261019T0712047113160000/282025 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v17 |
| ef:activity/change/20261019T0712047113160000/288782 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v18 |
| ef:activity/change/20261019T0712047113160000/324783 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v19 |
| ef:activity/change/20261019T0712047113160000/389842 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v19 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v20 |
| ef:activity/change/20261019T0712047113160000/397159 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v20 | ef:flow/4d9a8790-3ddd-11dd-8cd8-0050c2490048/v21 |