2-hydroxy-n-(2-hydroxyethyl)ethanaminium Acetate
Everything that changed this flow. Back to the flow
9e91bb00-1ca4-4792-b1b0-8900de7ff709
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=2-hydroxy-n-(2-hydroxyethyl)ethanaminiumacetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'23251-72-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f81232c318cf06af: {'23251-72-1': '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=['23251-72-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[159946, 24180697]; selected_pubchem_cids=[159946, 24180697]; 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 |
|---|---|---|---|---|---|
| 14,201 | bootstrap_labels | prefLabel | — | [{"@value":"2-hydroxy-n-(2-hydroxyethyl)ethanaminium acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | Bootstrapped prefLabel from legacy name field |
| 14,202 | bootstrap_labels | name | 2-hydroxy-n-(2-hydroxyethyl)ethanaminium acetate | — | Purged legacy name field to enforce prefLabel usage |
| 14,203 | bootstrap_labels | synonyms | ["organic","bis(2-hydroxyethyl)ammoniumacetate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 144,068 | 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 |
| 144,069 | 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 |
| 218,029 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,377 | normalize_name_case | prefLabel | [{"@value":"2-hydroxy-n-(2-hydroxyethyl)ethanaminium acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | [{"@value":"2-hydroxy-n-(2-hydroxyethyl)ethanaminium Acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,626 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 240,627 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,628 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.041.371","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['23251-72-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[159946, 24180697]; selected_pubchem_cids=[159946, 24180697]; 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 |
| 252,186 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | rdkit_pre_consensus from 'CC(=O)O.C(CO)NCCO'; added: molecular_mass, monoisotopic_mass |
| 260,933 | consensus_match | altLabel | [] | [{"@value":"<em>N</em>,<em>N</em>-Bis(2-hydroxyethylammonium) acetate","@language":"en","source":{"prov:wasGeneratedBy"… | group_key=2-hydroxy-n-(2-hydroxyethyl)ethanaminiumacetate||dimension=Environmental > media=Water > water_body=Unknown; cas=23251-72-1; added Common Chemistry CAS names as altLabel: <em>N</em>,<em>N</em>-Bis(2-hydroxyethylammonium) acetate, Diethanolamine acetate, Diethanolamine-acetic acid salt, Ethanol, 2,2′-iminobis-, acetate (1:1), Ethanol, 2,2′-iminobis-, acetate (salt), Ethanol, 2,2′-iminodi-, acetate (salt); object_uuid=fo-f81232c318cf06af |
| 260,934 | consensus_match | cas_match_labels | — | {"23251-72-1":"exactMatch"} | group_key=2-hydroxy-n-(2-hydroxyethyl)ethanaminiumacetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'23251-72-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f81232c318cf06af: {'23251-72-1': 'exactMatch'} |
| 277,381 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Diethanolamine acetate' |
| 284,061 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | rdkit_post_consensus from 'CC(=O)O.OCCNCCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,744 | dedupe_altlabels | altLabel | [{"@value":"<em>N</em>,<em>N</em>-Bis(2-hydroxyethylammonium) acetate","@language":"en","source":{"prov:wasGeneratedBy"… | [{"@value":"N,N-Bis(2-hydroxyethylammonium) acetate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | Deduplicated altLabel values and removed entries matching prefLabel |
| 353,036 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9e91bb00-1ca4-… | associations resolved on the elementary layer |
| 391,735 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15NO4"]… | typed the way the ontology types it |
| 399,907 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | 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/20260821T1302361922970000/14201 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v0 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v1 |
| ef:activity/change/20260821T1302361922970000/14202 | name | ef:agent/bootstrap_labels | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v1 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v2 |
| ef:activity/change/20260821T1302361922970000/14203 | synonyms | ef:agent/bootstrap_labels | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v2 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v3 |
| ef:activity/change/20260821T1302361922970000/144068 | context | ef:agent/default_context_mapping | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v3 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v4 |
| ef:activity/change/20260821T1302361922970000/144069 | context_iri | ef:agent/default_context_mapping | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v4 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v5 |
| ef:activity/change/20260821T1302361922970000/218029 | unit_iri | ef:agent/unit_normalization | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v5 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v6 |
| ef:activity/change/20260821T1302361922970000/224377 | prefLabel | ef:agent/normalize_name_case | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v6 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v7 |
| ef:activity/change/20260821T1302361922970000/240626 | properties | ef:agent/enrich_references | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v7 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v8 |
| ef:activity/change/20260821T1302361922970000/240627 | skos_definition | ef:agent/enrich_references | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v8 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v9 |
| ef:activity/change/20260821T1302361922970000/240628 | references | ef:agent/enrich_references | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v9 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v10 |
| ef:activity/change/20260821T1302361922970000/252186 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v10 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v11 |
| ef:activity/change/20260821T1302361922970000/260933 | altLabel | ef:agent/consensus_match | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v11 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v12 |
| ef:activity/change/20260821T1302361922970000/260934 | cas_match_labels | ef:agent/consensus_match | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v12 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v13 |
| ef:activity/change/20260821T1302361922970000/277381 | properties | ef:agent/opsin_iupac | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v13 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v14 |
| ef:activity/change/20260821T1302361922970000/284061 | properties | ef:agent/rdkit_post_consensus | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v14 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v15 |
| ef:activity/change/20260821T1302361922970000/292744 | altLabel | ef:agent/dedupe_altlabels | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v15 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v16 |
| ef:activity/change/20260821T1302361922970000/353036 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v16 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v17 |
| ef:activity/change/20260821T1302361922970000/391735 | properties | ef:agent/normalise_property_values | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v17 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v18 |
| ef:activity/change/20260821T1302361922970000/399907 | types | ef:agent/link_flows_to_their_substance | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v18 | ef:flow/9e91bb00-1ca4-4792-b1b0-8900de7ff709/v19 |