N-carboxymethyliminobis(ethylenenitrilo)tetra(acetic Acid)
Everything that changed this flow. Back to the flow
79b7d502-799e-40d5-9036-e094a684a7c4
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 5 catalogue altLabel value(s): 'CH 1730' (grade code), 'D 1' (grade code), 'D 50' (grade code), 'Dabeersen 503' (trade name), 'NSC 7340' (registry 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=n-carboxymethyliminobis(ethylenenitrilo)tetra(aceticacid)||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'67-43-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-820d29089dae177c: {'67-43-6': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['67-43-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_35739']; candidate_pubchem_cids=[3053, 638122, 21864618, 53405360]; selected_pubchem_cids=[3053]; 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 |
|---|---|---|---|---|---|
| 15,967 | bootstrap_labels | prefLabel | — | [{"@value":"N-carboxymethyliminobis(ethylenenitrilo)tetra(acetic acid)","@language":"en","source":{"prov:wasGeneratedBy… | Bootstrapped prefLabel from legacy name field |
| 15,968 | bootstrap_labels | name | N-carboxymethyliminobis(ethylenenitrilo)tetra(acetic acid) | — | Purged legacy name field to enforce prefLabel usage |
| 15,969 | bootstrap_labels | synonyms | ["(((Carboxymethyl)imino)bis(ethylenenitrilo))tetraacetic acid","(Carboxymethylimino)bis(ethylenenitrilo)tetraacetic ac… | [] | Removed legacy synonyms field in favor of structured labels |
| 122,176 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 122,177 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 218,586 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,762 | normalize_name_case | prefLabel | [{"@value":"N-carboxymethyliminobis(ethylenenitrilo)tetra(acetic acid)","@language":"en","source":{"prov:wasGeneratedBy… | [{"@value":"N-carboxymethyliminobis(ethylenenitrilo)tetra(acetic Acid)","@language":"en","source":{"prov:wasGeneratedBy… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,217 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 242,218 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,219 | enrich_references | references | [] | [{"@id":"beilstein:1810219","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['67-43-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_35739']; candidate_pubchem_cids=[3053, 638122, 21864618, 53405360]; selected_pubchem_cids=[3053]; 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 |
| 252,653 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | rdkit_pre_consensus from 'C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O'; added: monoisotopic_mass |
| 256,501 | chebi_altlabels | altLabel | [] | [{"@value":"1,1,4,7,7-diethylenetriaminepentaacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altla… | Added 15 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 269,520 | consensus_match | altLabel | [{"@value":"1,1,4,7,7-diethylenetriaminepentaacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altla… | [{"@value":"1,1,4,7,7-diethylenetriaminepentaacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altla… | group_key=n-carboxymethyliminobis(ethylenenitrilo)tetra(aceticacid)||dimension=Environmental > media=Air > strata=Long-term; cas=67-43-6; added Common Chemistry CAS names as altLabel: 2-[Bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid, 25: PN: WO2013046163 PAGE: 13 claimed sequence, 3,6,9-Triazaundecanedioic acid, 3,6,9-tris(carboxymethyl)-, Acetic acid, 2,2′,2′′,2′′′-[[(carboxymethyl)imino]bis(2,1-ethanediylnitrilo)]tetrakis-, CH 1730, Chel 330 acid, Chel DTPA, Chelest 3PA, Chelest PA, Chelest PA-SD, Clewat DA, D 1, D 50, DETP, DETPA, DPTA, Dabeersen 503, Detapac, Detarex, Diethylenetriamine-<em>N</em>,<em>N</em>,<em>N</em>′,<em>N</em>′′,<em>N</em>′′-pentaacetic acid, Dissolvine D, Dissolvine DTPA, Dissolvine DZ, Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, Hamp-Ex Acid, IP Chelate D 40, Monaquest CAI, NSC 7340, Pentacarboxymethyl diethylenetriamine, Trilon CS, [(2-[[2-(Bis-carboxymethyl-amino)-ethyl]-carboxymethyl-amino]-ethyl)-carboxymethyl-amino]-acetic acid, [[(Carboxymethyl)imino]bis(ethylenenitrilo)]tetraacetic acid; object_uuid=fo-820d29089dae177c |
| 269,521 | consensus_match | cas_match_labels | — | {"67-43-6":"exactMatch"} | group_key=n-carboxymethyliminobis(ethylenenitrilo)tetra(aceticacid)||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'67-43-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-820d29089dae177c: {'67-43-6': 'exactMatch'} |
| 277,860 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycine' |
| 284,568 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | rdkit_post_consensus from 'O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,511 | strip_catalogue_altlabels | altLabel | [{"@value":"1,1,4,7,7-diethylenetriaminepentaacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altla… | [{"@value":"1,1,4,7,7-diethylenetriaminepentaacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altla… | Removed 5 catalogue altLabel value(s): 'CH 1730' (grade code), 'D 1' (grade code), 'D 50' (grade code), 'Dabeersen 503' (trade name), 'NSC 7340' (registry code) |
| 342,086 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/79b7d502-799e-… | associations resolved on the elementary layer |
| 392,217 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H23N3O1… | typed the way the ontology types it |
| 400,569 | 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/20260822T0600486828500000/15967 | prefLabel | ef:agent/bootstrap_labels | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v0 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v1 |
| ef:activity/change/20260822T0600486828500000/15968 | name | ef:agent/bootstrap_labels | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v1 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v2 |
| ef:activity/change/20260822T0600486828500000/15969 | synonyms | ef:agent/bootstrap_labels | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v2 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v3 |
| ef:activity/change/20260822T0600486828500000/122176 | context | ef:agent/default_context_mapping | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v3 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v4 |
| ef:activity/change/20260822T0600486828500000/122177 | context_iri | ef:agent/default_context_mapping | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v4 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v5 |
| ef:activity/change/20260822T0600486828500000/218586 | unit_iri | ef:agent/unit_normalization | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v5 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v6 |
| ef:activity/change/20260822T0600486828500000/224762 | prefLabel | ef:agent/normalize_name_case | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v6 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v7 |
| ef:activity/change/20260822T0600486828500000/242217 | properties | ef:agent/enrich_references | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v7 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v8 |
| ef:activity/change/20260822T0600486828500000/242218 | skos_definition | ef:agent/enrich_references | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v8 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v9 |
| ef:activity/change/20260822T0600486828500000/242219 | references | ef:agent/enrich_references | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v9 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v10 |
| ef:activity/change/20260822T0600486828500000/252653 | properties | ef:agent/rdkit_pre_consensus | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v10 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v11 |
| ef:activity/change/20260822T0600486828500000/256501 | altLabel | ef:agent/chebi_altlabels | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v11 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v12 |
| ef:activity/change/20260822T0600486828500000/269520 | altLabel | ef:agent/consensus_match | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v12 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v13 |
| ef:activity/change/20260822T0600486828500000/269521 | cas_match_labels | ef:agent/consensus_match | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v13 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v14 |
| ef:activity/change/20260822T0600486828500000/277860 | properties | ef:agent/opsin_iupac | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v14 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v15 |
| ef:activity/change/20260822T0600486828500000/284568 | properties | ef:agent/rdkit_post_consensus | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v15 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v16 |
| ef:activity/change/20260822T0600486828500000/290511 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v16 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v17 |
| ef:activity/change/20260822T0600486828500000/342086 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v17 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v18 |
| ef:activity/change/20260822T0600486828500000/392217 | properties | ef:agent/normalise_property_values | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v18 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v19 |
| ef:activity/change/20260822T0600486828500000/400569 | types | ef:agent/link_flows_to_their_substance | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v19 | ef:flow/79b7d502-799e-40d5-9036-e094a684a7c4/v20 |