N-[3-(dimethylamino)propyl]octadecanamide
Everything that changed this flow. Back to the flow
7375be94-9157-43b7-aa8c-20dc6c10f645
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): 'NSC 86167' (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-[3-(dimethylamino)propyl]octadecanamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'7651-02-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0c02a68cf06a09b6: {'7651-02-7': '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 water > Emissions to water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['7651-02-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[62109]; selected_pubchem_cids=[62109]; 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 |
|---|---|---|---|---|---|
| 13,287 | bootstrap_labels | prefLabel | — | [{"@value":"n-[3-(dimethylamino)propyl]octadecanamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labe… | Bootstrapped prefLabel from legacy name field |
| 13,288 | bootstrap_labels | name | n-[3-(dimethylamino)propyl]octadecanamide | — | Purged legacy name field to enforce prefLabel usage |
| 13,289 | bootstrap_labels | synonyms | ["organic","n-[3-(dimethylamino)propyl]stearamide","incrominetmsd-[pg]-pa-(mh)"] | [] | Removed legacy synonyms field in favor of structured labels |
| 118,538 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 118,539 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 217,731 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,174 | normalize_name_case | prefLabel | [{"@value":"n-[3-(dimethylamino)propyl]octadecanamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labe… | [{"@value":"N-[3-(dimethylamino)propyl]octadecanamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labe… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,779 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,780 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,781 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J215.881G","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['7651-02-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[62109]; selected_pubchem_cids=[62109]; 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 |
| 251,939 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C'; added: molecular_mass, monoisotopic_mass |
| 269,448 | consensus_match | altLabel | [] | [{"@value":"<em>N</em>,<em>N</em>-Dimethyl-3-(octadecanoylamino)propylamine","@language":"en","source":{"prov:wasGenera… | group_key=n-[3-(dimethylamino)propyl]octadecanamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=7651-02-7; added Common Chemistry CAS names as altLabel: <em>N</em>,<em>N</em>-Dimethyl-3-(octadecanoylamino)propylamine, <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-stearoyl-1,3-propanediamine, <em>N</em>-(3-Stearoylaminopropyl)-<em>N</em>,<em>N</em>-dimethylamine, <em>N</em>-[3-(Dimethylamino)-1-propyl]octadecanamide, <em>N</em>-[3-(Dimethylamino)propyl]stearamide, <em>N</em>′,<em>N</em>′-Dimethyl-<em>N</em>-octadecanoyl-1,3-diaminopropane, ASCO-SAPDA, Adogen S 18V, Amidoamine APA 168-65E, Armeen APA 168-65E, Armeen APA 168E, Catinal MPAS, Catinol MPAS, Catiogen SPA, Chamide PKO-S, Chemidex S, Dehyquart S 18, Genamin SPA, Incromine SB, Incromine SD, Incromine SD-PA-MH, Lexamine S 13, Lipomin APA 168-65E, NSC 86167, Nikkol Amidoamine MPS, Octadecanamide, <em>N</em>-[3-(dimethylamino)propyl]-, Palner SDPA, SAPDMA, SP Polawax NF-MBAL-PA-RB, Stearamidopropyl dimethylamine, Stearic acid 3-(dimethylaminopropyl)amide, Stearic acid dimethylaminopropylamide, Stearylamidopropyldimethylamine, Stepan SAA, Tegamine S 13, Tego Amid S 18; object_uuid=fo-0c02a68cf06a09b6 |
| 269,449 | consensus_match | cas_match_labels | — | {"7651-02-7":"exactMatch"} | group_key=n-[3-(dimethylamino)propyl]octadecanamide||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'7651-02-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0c02a68cf06a09b6: {'7651-02-7': 'exactMatch'} |
| 277,135 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'N-[3-(dimethylamino)propyl]octadecanamide' |
| 283,795 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | rdkit_post_consensus from 'CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,987 | strip_catalogue_altlabels | altLabel | [{"@value":"<em>N</em>,<em>N</em>-Dimethyl-3-(octadecanoylamino)propylamine","@language":"en","source":{"prov:wasGenera… | [{"@value":"N,N-Dimethyl-3-(octadecanoylamino)propylamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_… | Removed 1 catalogue altLabel value(s): 'NSC 86167' (registry code) |
| 340,267 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7375be94-9157-… | associations resolved on the elementary layer |
| 391,484 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H48N2O"… | typed the way the ontology types it |
| 399,538 | 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/20260822T0600486828500000/13287 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v0 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v1 |
| ef:activity/change/20260822T0600486828500000/13288 | name | ef:agent/bootstrap_labels | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v1 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v2 |
| ef:activity/change/20260822T0600486828500000/13289 | synonyms | ef:agent/bootstrap_labels | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v2 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v3 |
| ef:activity/change/20260822T0600486828500000/118538 | context | ef:agent/default_context_mapping | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v3 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v4 |
| ef:activity/change/20260822T0600486828500000/118539 | context_iri | ef:agent/default_context_mapping | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v4 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v5 |
| ef:activity/change/20260822T0600486828500000/217731 | unit_iri | ef:agent/unit_normalization | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v5 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v6 |
| ef:activity/change/20260822T0600486828500000/224174 | prefLabel | ef:agent/normalize_name_case | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v6 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v7 |
| ef:activity/change/20260822T0600486828500000/239779 | properties | ef:agent/enrich_references | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v7 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v8 |
| ef:activity/change/20260822T0600486828500000/239780 | skos_definition | ef:agent/enrich_references | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v8 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v9 |
| ef:activity/change/20260822T0600486828500000/239781 | references | ef:agent/enrich_references | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v9 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v10 |
| ef:activity/change/20260822T0600486828500000/251939 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v10 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v11 |
| ef:activity/change/20260822T0600486828500000/269448 | altLabel | ef:agent/consensus_match | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v11 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v12 |
| ef:activity/change/20260822T0600486828500000/269449 | cas_match_labels | ef:agent/consensus_match | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v12 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v13 |
| ef:activity/change/20260822T0600486828500000/277135 | properties | ef:agent/opsin_iupac | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v13 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v14 |
| ef:activity/change/20260822T0600486828500000/283795 | properties | ef:agent/rdkit_post_consensus | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v14 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v15 |
| ef:activity/change/20260822T0600486828500000/289987 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v15 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v16 |
| ef:activity/change/20260822T0600486828500000/340267 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v16 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v17 |
| ef:activity/change/20260822T0600486828500000/391484 | properties | ef:agent/normalise_property_values | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v17 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v18 |
| ef:activity/change/20260822T0600486828500000/399538 | types | ef:agent/link_flows_to_their_substance | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v18 | ef:flow/7375be94-9157-43b7-aa8c-20dc6c10f645/v19 |