2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminium Dichloride
Everything that changed this flow. Back to the flow
e06564a5-d6ad-4e4c-9784-0ce09847b6c7
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, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'Colamoist 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=2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminiumdichloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'110528-94-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a9dba3f32196abb1: {'110528-94-4': '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 air > Emissions to lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['110528-94-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[13949876]; selected_pubchem_cids=[13949876]; 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 |
|---|---|---|---|---|---|
| 14,843 | bootstrap_labels | prefLabel | — | [{"@value":"2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminium dichloride","@language":"en",… | Bootstrapped prefLabel from legacy name field |
| 14,844 | bootstrap_labels | name | 2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminium dichloride | — | Purged legacy name field to enforce prefLabel usage |
| 14,845 | bootstrap_labels | synonyms | ["2-hydroxy-n,n'","-bis(2-hydroxyethyl)-n,n,n'",",n'","-tetramethylpropane-1,3-diaminiumdichloride","colaâ®… | [] | Removed legacy synonyms field in favor of structured labels |
| 183,478 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 183,479 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 218,232 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,515 | normalize_name_case | prefLabel | [{"@value":"2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminium dichloride","@language":"en",… | [{"@value":"2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminium Dichloride","@language":"en",… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,221 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,222 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,223 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.234.630","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['110528-94-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[13949876]; selected_pubchem_cids=[13949876]; 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 |
| 252,360 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | rdkit_pre_consensus from 'C[N+](C)(CCO)CC(C[N+](C)(C)CCO)O.[Cl-].[Cl-]'; added: molecular_mass, monoisotopic_mass |
| 260,927 | consensus_match | altLabel | [] | [{"@value":"1,3-Propanediaminium, 2-hydroxy-<em>N</em>,<em>N</em>′-bis(2-hydroxyethyl)-<em>N</em>,<em>N</em>,<em>N</em>… | group_key=2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminiumdichloride||dimension=Environmental > media=Water > water_body=Unknown; cas=110528-94-4; added Common Chemistry CAS names as altLabel: 1,3-Propanediaminium, 2-hydroxy-<em>N</em>,<em>N</em>′-bis(2-hydroxyethyl)-<em>N</em>,<em>N</em>,<em>N</em>′,<em>N</em>′-tetramethyl-, dichloride, 1,3-Propanediaminium, 2-hydroxy-<em>N</em><sup>1</sup>,<em>N</em><sup>3</sup>-bis(2-hydroxyethyl)-<em>N</em><sup>1</sup>,<em>N</em><sup>1</sup>,<em>N</em><sup>3</sup>,<em>N</em><sup>3</sup>-tetramethyl-, chloride (1:2), Colamoist 200, Hydroxypropylbishydroxyethyldimonium chloride; object_uuid=fo-a9dba3f32196abb1 |
| 260,928 | consensus_match | cas_match_labels | — | {"110528-94-4":"exactMatch"} | group_key=2-hydroxy-n,n'-bis(2-hydroxyethyl)-n,n,n',n'-tetramethylpropane-1,3-diaminiumdichloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'110528-94-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a9dba3f32196abb1: {'110528-94-4': 'exactMatch'} |
| 277,554 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3-Propanediaminium, 2-hydroxy-N,N′-bis(2-hydroxyethyl)-N,N,N′,N′-tetramethyl-, dichloride' |
| 284,250 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | rdkit_post_consensus from 'C[N+](C)(CCO)CC(O)C[N+](C)(C)CCO.[Cl-].[Cl-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,294 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3-Propanediaminium, 2-hydroxy-<em>N</em>,<em>N</em>′-bis(2-hydroxyethyl)-<em>N</em>,<em>N</em>,<em>N</em>… | [{"@value":"1,3-Propanediaminium, 2-hydroxy-N,N′-bis(2-hydroxyethyl)-N,N,N′,N′-tetramethyl-, dichloride","@language":"e… | Removed 1 catalogue altLabel value(s): 'Colamoist 200' (trade name) |
| 372,766 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e06564a5-d6ad-… | associations resolved on the elementary layer |
| 391,912 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H28Cl2N… | typed the way the ontology types it |
| 400,150 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1554374006150000/14843 | prefLabel | ef:agent/bootstrap_labels | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v0 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v1 |
| ef:activity/change/20260821T1554374006150000/14844 | name | ef:agent/bootstrap_labels | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v1 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v2 |
| ef:activity/change/20260821T1554374006150000/14845 | synonyms | ef:agent/bootstrap_labels | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v2 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v3 |
| ef:activity/change/20260821T1554374006150000/183478 | context | ef:agent/default_context_mapping | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v3 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v4 |
| ef:activity/change/20260821T1554374006150000/183479 | context_iri | ef:agent/default_context_mapping | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v4 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v5 |
| ef:activity/change/20260821T1554374006150000/218232 | unit_iri | ef:agent/unit_normalization | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v5 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v6 |
| ef:activity/change/20260821T1554374006150000/224515 | prefLabel | ef:agent/normalize_name_case | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v6 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v7 |
| ef:activity/change/20260821T1554374006150000/241221 | properties | ef:agent/enrich_references | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v7 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v8 |
| ef:activity/change/20260821T1554374006150000/241222 | skos_definition | ef:agent/enrich_references | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v8 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v9 |
| ef:activity/change/20260821T1554374006150000/241223 | references | ef:agent/enrich_references | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v9 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v10 |
| ef:activity/change/20260821T1554374006150000/252360 | properties | ef:agent/rdkit_pre_consensus | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v10 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v11 |
| ef:activity/change/20260821T1554374006150000/260927 | altLabel | ef:agent/consensus_match | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v11 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v12 |
| ef:activity/change/20260821T1554374006150000/260928 | cas_match_labels | ef:agent/consensus_match | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v12 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v13 |
| ef:activity/change/20260821T1554374006150000/277554 | properties | ef:agent/opsin_iupac | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v13 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v14 |
| ef:activity/change/20260821T1554374006150000/284250 | properties | ef:agent/rdkit_post_consensus | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v14 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v15 |
| ef:activity/change/20260821T1554374006150000/290294 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v15 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v16 |
| ef:activity/change/20260821T1554374006150000/372766 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v16 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v17 |
| ef:activity/change/20260821T1554374006150000/391912 | properties | ef:agent/normalise_property_values | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v17 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v18 |
| ef:activity/change/20260821T1554374006150000/400150 | types | ef:agent/link_flows_to_their_substance | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v18 | ef:flow/e06564a5-d6ad-4e4c-9784-0ce09847b6c7/v19 |