N~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine
Everything that changed this flow. Back to the flow
56cf0e51-d6c3-48ca-a446-bb7614136dcd
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 1 catalogue altLabel value(s): 'NSC 180823' (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~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory']; cas_sources={'10563-26-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f73750000e4fd6dc: {'10563-26-5': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['10563-26-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39476']; candidate_pubchem_cids=[25378, 15490212, 45098094, 53421515]; selected_pubchem_cids=[25378]; 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 |
|---|---|---|---|---|---|
| 10,967 | bootstrap_labels | prefLabel | — | [{"@value":"n~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | Bootstrapped prefLabel from legacy name field |
| 10,968 | bootstrap_labels | name | n~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine | — | Purged legacy name field to enforce prefLabel usage |
| 10,969 | bootstrap_labels | synonyms | ["organic","n,n'","-bis(3-aminopropyl)ethylenediamine","1,10-diamino-4,7-diazadecane","1,2-bis(3-aminopropyl)ethyle… | [] | Removed legacy synonyms field in favor of structured labels |
| 101,396 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 101,397 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 216,976 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,652 | normalize_name_case | prefLabel | [{"@value":"n~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | [{"@value":"N~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 237,617 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 237,618 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,619 | enrich_references | references | [] | [{"@id":"beilstein:2203748","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['10563-26-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39476']; candidate_pubchem_cids=[25378, 15490212, 45098094, 53421515]; selected_pubchem_cids=[25378]; 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 |
| 251,312 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | rdkit_pre_consensus from 'C(CN)CNCCNCCCN'; added: monoisotopic_mass |
| 255,922 | chebi_altlabels | altLabel | [] | [{"@value":"1,5,8,12-tetraazadodecane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Added 8 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 269,966 | consensus_match | altLabel | [{"@value":"1,5,8,12-tetraazadodecane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"1,5,8,12-tetraazadodecane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | group_key=n~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine||dimension=Environmental > media=Water > water_body=Surface water; cas=10563-26-5; added Common Chemistry CAS names as altLabel: 1,10-Diamino-4,7-diazadecane, 1,2-Bis(3-aminopropyl)ethylenediamine, 1,2-Bis(3-aminopropylamino)ethane, 1,3-Propanediamine, <em>N</em>,<em>N</em>′′-1,2-ethanediylbis-, 1,3-Propanediamine, <em>N</em>,<em>N</em>′′-ethylenebis-, 1,3-Propanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>1′</sup>-1,2-ethanediylbis-, 3,2,3-Tet, 4,7-Diazadecane-1,10-diamine, <em>N</em>,<em>N</em>-1,2-Ethanediylbis-1,3-propanediamine, <em>N</em>,<em>N</em>′-Bis(3-aminopropyl)-1,2-diaminoethane, <em>N</em>,<em>N</em>′-Bis(3-aminopropyl)-1,2-ethanediamine, <em>N</em>,<em>N</em>′-Bis(3-aminopropyl)diaminoethane, <em>N</em>,<em>N</em>′-Bis(3-aminopropyl)ethylenediamine, <em>N</em>,<em>N</em>′-Di(3-aminopropyl)-1,2-ethylenediamine, <em>N</em>,<em>N</em>′-Diaminopropylethylenediamine, <em>N</em>,<em>N</em>′-Ethane-1,2-diylbis(1,3-propanediamine), <em>N</em>,<em>N</em>′′-1,2-Ethanediylbis(1,3-propandiamine), <em>N</em>-[2-(3-Aminopropylamino)ethyl]-1,3-propanediamine, BAPEN, Bis(3-aminopropyl)ethylenediamine, N<sub>4</sub> Amine, NSC 180823, Rhodoline Hd-N 4; object_uuid=fo-f73750000e4fd6dc |
| 269,967 | consensus_match | cas_match_labels | — | {"10563-26-5":"exactMatch"} | group_key=n~1~',n~3~-ethane-1,2-diyldipropane-1,3-diamine||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory']; cas_sources={'10563-26-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f73750000e4fd6dc: {'10563-26-5': 'exactMatch'} |
| 276,498 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,5,8,12-tetraazadodecane' |
| 283,106 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | rdkit_post_consensus from 'NCCCNCCNCCCN'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,534 | strip_catalogue_altlabels | altLabel | [{"@value":"1,5,8,12-tetraazadodecane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"1,5,8,12-tetraazadodecane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Removed 1 catalogue altLabel value(s): 'NSC 180823' (registry code) |
| 331,695 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/56cf0e51-d6c3-… | associations resolved on the elementary layer |
| 390,852 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H22N4"],… | typed the way the ontology types it |
| 398,644 | 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/20260822T0600486828500000/10967 | prefLabel | ef:agent/bootstrap_labels | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v0 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v1 |
| ef:activity/change/20260822T0600486828500000/10968 | name | ef:agent/bootstrap_labels | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v1 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v2 |
| ef:activity/change/20260822T0600486828500000/10969 | synonyms | ef:agent/bootstrap_labels | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v2 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v3 |
| ef:activity/change/20260822T0600486828500000/101396 | context | ef:agent/default_context_mapping | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v3 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v4 |
| ef:activity/change/20260822T0600486828500000/101397 | context_iri | ef:agent/default_context_mapping | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v4 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v5 |
| ef:activity/change/20260822T0600486828500000/216976 | unit_iri | ef:agent/unit_normalization | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v5 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v6 |
| ef:activity/change/20260822T0600486828500000/223652 | prefLabel | ef:agent/normalize_name_case | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v6 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v7 |
| ef:activity/change/20260822T0600486828500000/237617 | properties | ef:agent/enrich_references | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v7 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v8 |
| ef:activity/change/20260822T0600486828500000/237618 | skos_definition | ef:agent/enrich_references | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v8 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v9 |
| ef:activity/change/20260822T0600486828500000/237619 | references | ef:agent/enrich_references | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v9 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v10 |
| ef:activity/change/20260822T0600486828500000/251312 | properties | ef:agent/rdkit_pre_consensus | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v10 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v11 |
| ef:activity/change/20260822T0600486828500000/255922 | altLabel | ef:agent/chebi_altlabels | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v11 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v12 |
| ef:activity/change/20260822T0600486828500000/269966 | altLabel | ef:agent/consensus_match | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v12 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v13 |
| ef:activity/change/20260822T0600486828500000/269967 | cas_match_labels | ef:agent/consensus_match | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v13 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v14 |
| ef:activity/change/20260822T0600486828500000/276498 | properties | ef:agent/opsin_iupac | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v14 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v15 |
| ef:activity/change/20260822T0600486828500000/283106 | properties | ef:agent/rdkit_post_consensus | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v15 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v16 |
| ef:activity/change/20260822T0600486828500000/289534 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v16 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v17 |
| ef:activity/change/20260822T0600486828500000/331695 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v17 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v18 |
| ef:activity/change/20260822T0600486828500000/390852 | properties | ef:agent/normalise_property_values | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v18 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v19 |
| ef:activity/change/20260822T0600486828500000/398644 | types | ef:agent/link_flows_to_their_substance | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v19 | ef:flow/56cf0e51-d6c3-48ca-a446-bb7614136dcd/v20 |