N1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine
Everything that changed this flow. Back to the flow
090b0084-a53a-497b-a853-1186be901ba0
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): 'Adogen 580' (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=n1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'72162-46-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3c2133bbd065870c: {'72162-46-0': '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 air, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['72162-46-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[174951]; selected_pubchem_cids=[174951]; 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 |
|---|---|---|---|---|---|
| 9,342 | bootstrap_labels | prefLabel | — | [{"@value":"n1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine","@language":"en","source":{"prov:wasGeneratedBy… | Bootstrapped prefLabel from legacy name field |
| 9,343 | bootstrap_labels | name | n1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine | — | Purged legacy name field to enforce prefLabel usage |
| 9,344 | bootstrap_labels | synonyms | ["n-[3-(isodecyloxy)propyl]propane-1,3-diamine","(3-aminopropyl)({3-[(2-methylnonyl)oxy]propyl})amine","isodecyletherdi… | [] | Removed legacy synonyms field in favor of structured labels |
| 41,902 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 41,903 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 216,446 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,291 | normalize_name_case | prefLabel | [{"@value":"n1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine","@language":"en","source":{"prov:wasGeneratedBy… | [{"@value":"N1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine","@language":"en","source":{"prov:wasGeneratedBy… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,116 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,117 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,118 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J447.087G","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['72162-46-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[174951]; selected_pubchem_cids=[174951]; 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 |
| 250,885 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | rdkit_pre_consensus from 'CC(C)CCCCCCCOCCCNCCCN'; added: molecular_mass, monoisotopic_mass |
| 269,689 | consensus_match | altLabel | [] | [{"@value":"1,3-Propanediamine, <em>N</em>-[3-(isodecyloxy)propyl]-","@language":"en","source":{"prov:wasGeneratedBy":"… | group_key=n1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine||dimension=Environmental > media=Air > indoor=Unknown; cas=72162-46-0; added Common Chemistry CAS names as altLabel: 1,3-Propanediamine, <em>N</em>-[3-(isodecyloxy)propyl]-, <em>N</em>-[3-(Isodecyloxy)propyl]-1,3-propanediamine, Adogen 580, Tomah DA 14; object_uuid=fo-3c2133bbd065870c |
| 269,690 | consensus_match | cas_match_labels | — | {"72162-46-0":"exactMatch"} | group_key=n1-[3-(decylalkyl-(branched)oxy)propyl]propane-1,3-diamine||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'72162-46-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3c2133bbd065870c: {'72162-46-0': 'exactMatch'} |
| 276,073 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-' |
| 282,645 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | rdkit_post_consensus from 'CC(C)CCCCCCCOCCCNCCCN'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,215 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3-Propanediamine, <em>N</em>-[3-(isodecyloxy)propyl]-","@language":"en","source":{"prov:wasGeneratedBy":"… | [{"@value":"1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | Removed 1 catalogue altLabel value(s): 'Adogen 580' (trade name) |
| 301,976 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/090b0084-a53a-… | associations resolved on the elementary layer |
| 390,418 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36N2O"… | typed the way the ontology types it |
| 398,015 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260822T0600486828500000/9342 | prefLabel | ef:agent/bootstrap_labels | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v0 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v1 |
| ef:activity/change/20260822T0600486828500000/9343 | name | ef:agent/bootstrap_labels | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v1 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v2 |
| ef:activity/change/20260822T0600486828500000/9344 | synonyms | ef:agent/bootstrap_labels | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v2 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v3 |
| ef:activity/change/20260822T0600486828500000/41902 | context | ef:agent/default_context_mapping | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v3 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v4 |
| ef:activity/change/20260822T0600486828500000/41903 | context_iri | ef:agent/default_context_mapping | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v4 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v5 |
| ef:activity/change/20260822T0600486828500000/216446 | unit_iri | ef:agent/unit_normalization | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v5 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v6 |
| ef:activity/change/20260822T0600486828500000/223291 | prefLabel | ef:agent/normalize_name_case | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v6 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v7 |
| ef:activity/change/20260822T0600486828500000/236116 | properties | ef:agent/enrich_references | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v7 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v8 |
| ef:activity/change/20260822T0600486828500000/236117 | skos_definition | ef:agent/enrich_references | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v8 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v9 |
| ef:activity/change/20260822T0600486828500000/236118 | references | ef:agent/enrich_references | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v9 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v10 |
| ef:activity/change/20260822T0600486828500000/250885 | properties | ef:agent/rdkit_pre_consensus | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v10 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v11 |
| ef:activity/change/20260822T0600486828500000/269689 | altLabel | ef:agent/consensus_match | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v11 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v12 |
| ef:activity/change/20260822T0600486828500000/269690 | cas_match_labels | ef:agent/consensus_match | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v12 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v13 |
| ef:activity/change/20260822T0600486828500000/276073 | properties | ef:agent/opsin_iupac | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v13 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v14 |
| ef:activity/change/20260822T0600486828500000/282645 | properties | ef:agent/rdkit_post_consensus | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v14 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v15 |
| ef:activity/change/20260822T0600486828500000/289215 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v15 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v16 |
| ef:activity/change/20260822T0600486828500000/301976 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v16 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v17 |
| ef:activity/change/20260822T0600486828500000/390418 | properties | ef:agent/normalise_property_values | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v17 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v18 |
| ef:activity/change/20260822T0600486828500000/398015 | types | ef:agent/link_flows_to_their_substance | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v18 | ef:flow/090b0084-a53a-497b-a853-1186be901ba0/v19 |