(2s)-n, N’-dibutyl-2-(2-ethylhexanamido)pentanediamide
Everything that changed this flow. Back to the flow
810b56af-38da-444f-a499-72caec437dda
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'EB 21' (grade 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=(2s)-n,n’-dibutyl-2-(2-ethylhexanamido)pentanediamide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=[]; cas_sources={'486455-65-6': []}; assigned CAS labels from group consensus; object_uuid=fo-0b09ead8223c1ff6: {'486455-65-6': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['486455-65-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[11417726]; selected_pubchem_cids=[11417726]; 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 |
|---|---|---|---|---|---|
| 14,495 | bootstrap_labels | prefLabel | — | [{"@value":"(2s)-n, n’-dibutyl-2-(2-ethylhexanamido)pentanediamide","@language":"en","source":{"prov:wasGeneratedBy":"b… | Bootstrapped prefLabel from legacy name field |
| 14,496 | bootstrap_labels | name | (2s)-n, n’-dibutyl-2-(2-ethylhexanamido)pentanediamide | — | Purged legacy name field to enforce prefLabel usage |
| 14,497 | bootstrap_labels | synonyms | ["gelatinizationagenteb-21","(2s)-n,nâ??-dibutyl-2-(2-ethylhexanamido)pentanediamide","(2s)-n,n'","-dibutyl-2-(2-et… | [] | Removed legacy synonyms field in favor of structured labels |
| 126,454 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 126,455 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 218,129 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,451 | normalize_name_case | prefLabel | [{"@value":"(2s)-n, n’-dibutyl-2-(2-ethylhexanamido)pentanediamide","@language":"en","source":{"prov:wasGeneratedBy":"b… | [{"@value":"(2s)-n, N’-dibutyl-2-(2-ethylhexanamido)pentanediamide","@language":"en","source":{"prov:wasGeneratedBy":"b… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,911 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 240,912 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,913 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.479.191B","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['486455-65-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[11417726]; selected_pubchem_cids=[11417726]; 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 |
| 252,278 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | rdkit_pre_consensus from 'CCCCC(CC)C(=O)NC(CCC(=O)NCCCC)C(=O)NCCCC'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 257,686 | consensus_match | altLabel | [] | [{"@value":"(2<em>S</em>)-<em>N</em><sup>1</sup>,<em>N</em><sup>5</sup>-Dibutyl-2-[(2-ethyl-1-oxohexyl)amino]pentanedia… | group_key=(2s)-n,n’-dibutyl-2-(2-ethylhexanamido)pentanediamide||dimension=Environmental > media=Water > water_body=Long-term; cas=486455-65-6; added Common Chemistry CAS names as altLabel: (2<em>S</em>)-<em>N</em><sup>1</sup>,<em>N</em><sup>5</sup>-Dibutyl-2-[(2-ethyl-1-oxohexyl)amino]pentanediamide, Dibutyl ethylhexanoyl glutamide, EB 21, Pentanediamide, <em>N</em>,<em>N</em>′-dibutyl-2-[(2-ethyl-1-oxohexyl)amino]-, (2<em>S</em>)-, Pentanediamide, <em>N</em><sup>1</sup>,<em>N</em><sup>5</sup>-dibutyl-2-[(2-ethyl-1-oxohexyl)amino]-, (2<em>S</em>)-; object_uuid=fo-0b09ead8223c1ff6 |
| 257,687 | consensus_match | cas_match_labels | — | {"486455-65-6":"exactMatch"} | group_key=(2s)-n,n’-dibutyl-2-(2-ethylhexanamido)pentanediamide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=[]; cas_sources={'486455-65-6': []}; assigned CAS labels from group consensus; object_uuid=fo-0b09ead8223c1ff6: {'486455-65-6': 'exactMatch'} |
| 277,486 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(2S)-N1,N5-Dibutyl-2-[(2-ethyl-1-oxohexyl)amino]pentanediamide' |
| 284,172 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | rdkit_post_consensus from 'CCCCNC(=O)CC[C@H](NC(=O)C(CC)CCCC)C(=O)NCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,248 | strip_catalogue_altlabels | altLabel | [{"@value":"(2<em>S</em>)-<em>N</em><sup>1</sup>,<em>N</em><sup>5</sup>-Dibutyl-2-[(2-ethyl-1-oxohexyl)amino]pentanedia… | [{"@value":"(2S)-N1,N5-Dibutyl-2-[(2-ethyl-1-oxohexyl)amino]pentanediamide","@language":"en","source":{"prov:wasGenerat… | Removed 1 catalogue altLabel value(s): 'EB 21' (grade code) |
| 344,249 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/810b56af-38da-… | associations resolved on the elementary layer |
| 391,841 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | typed the way the ontology types it |
| 400,041 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 400,042 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H41N3O3… | 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/20260820T0738569779880000/14495 | prefLabel | ef:agent/bootstrap_labels | ef:flow/810b56af-38da-444f-a499-72caec437dda/v0 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v1 |
| ef:activity/change/20260820T0738569779880000/14496 | name | ef:agent/bootstrap_labels | ef:flow/810b56af-38da-444f-a499-72caec437dda/v1 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v2 |
| ef:activity/change/20260820T0738569779880000/14497 | synonyms | ef:agent/bootstrap_labels | ef:flow/810b56af-38da-444f-a499-72caec437dda/v2 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v3 |
| ef:activity/change/20260820T0738569779880000/126454 | context | ef:agent/default_context_mapping | ef:flow/810b56af-38da-444f-a499-72caec437dda/v3 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v4 |
| ef:activity/change/20260820T0738569779880000/126455 | context_iri | ef:agent/default_context_mapping | ef:flow/810b56af-38da-444f-a499-72caec437dda/v4 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v5 |
| ef:activity/change/20260820T0738569779880000/218129 | unit_iri | ef:agent/unit_normalization | ef:flow/810b56af-38da-444f-a499-72caec437dda/v5 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v6 |
| ef:activity/change/20260820T0738569779880000/224451 | prefLabel | ef:agent/normalize_name_case | ef:flow/810b56af-38da-444f-a499-72caec437dda/v6 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v7 |
| ef:activity/change/20260820T0738569779880000/240911 | properties | ef:agent/enrich_references | ef:flow/810b56af-38da-444f-a499-72caec437dda/v7 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v8 |
| ef:activity/change/20260820T0738569779880000/240912 | skos_definition | ef:agent/enrich_references | ef:flow/810b56af-38da-444f-a499-72caec437dda/v8 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v9 |
| ef:activity/change/20260820T0738569779880000/240913 | references | ef:agent/enrich_references | ef:flow/810b56af-38da-444f-a499-72caec437dda/v9 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v10 |
| ef:activity/change/20260820T0738569779880000/252278 | properties | ef:agent/rdkit_pre_consensus | ef:flow/810b56af-38da-444f-a499-72caec437dda/v10 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v11 |
| ef:activity/change/20260820T0738569779880000/257686 | altLabel | ef:agent/consensus_match | ef:flow/810b56af-38da-444f-a499-72caec437dda/v11 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v12 |
| ef:activity/change/20260820T0738569779880000/257687 | cas_match_labels | ef:agent/consensus_match | ef:flow/810b56af-38da-444f-a499-72caec437dda/v12 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v13 |
| ef:activity/change/20260820T0738569779880000/277486 | properties | ef:agent/opsin_iupac | ef:flow/810b56af-38da-444f-a499-72caec437dda/v13 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v14 |
| ef:activity/change/20260820T0738569779880000/284172 | properties | ef:agent/rdkit_post_consensus | ef:flow/810b56af-38da-444f-a499-72caec437dda/v14 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v15 |
| ef:activity/change/20260820T0738569779880000/290248 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/810b56af-38da-444f-a499-72caec437dda/v15 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v16 |
| ef:activity/change/20260820T0738569779880000/344249 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/810b56af-38da-444f-a499-72caec437dda/v16 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v17 |
| ef:activity/change/20260820T0738569779880000/391841 | properties | ef:agent/normalise_property_values | ef:flow/810b56af-38da-444f-a499-72caec437dda/v17 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v18 |
| ef:activity/change/20260820T0738569779880000/400041 | types | ef:agent/link_flows_to_their_substance | ef:flow/810b56af-38da-444f-a499-72caec437dda/v18 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v19 |
| ef:activity/change/20260820T0738569779880000/400042 | properties | ef:agent/link_flows_to_their_substance | ef:flow/810b56af-38da-444f-a499-72caec437dda/v19 | ef:flow/810b56af-38da-444f-a499-72caec437dda/v20 |