N-(2-hydroxyethyl)-3,5,5-trimethylhexanamide
Everything that changed this flow. Back to the flow
9a46d290-b47f-40c1-86b2-22532fc2d60e
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide||dimension=Environmental > media=Air > strata=Unknown; cas=1154308-86-7; added Common Chemistry CAS names as altLabel: Hexanamide, <em>N</em>-(2-hydroxyethyl)-3,5,5-trimethyl-; object_uuid=fo-73c43c795bb2c9a5 |
| cas_match_labels | 1 | consensus_match | group_key=n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'1154308-86-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-73c43c795bb2c9a5: {'1154308-86-7': '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 air > Emissions to non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1154308-86-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[43501033]; selected_pubchem_cids=[43501033]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 14,933 | bootstrap_labels | prefLabel | — | [{"@value":"n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Bootstrapped prefLabel from legacy name field |
| 14,934 | bootstrap_labels | name | n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide | — | Purged legacy name field to enforce prefLabel usage |
| 14,935 | bootstrap_labels | synonyms | ["organic","additolsxw6246/90"] | [] | Removed legacy synonyms field in favor of structured labels |
| 141,416 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 141,417 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 218,259 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,536 | normalize_name_case | prefLabel | [{"@value":"n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | [{"@value":"N-(2-hydroxyethyl)-3,5,5-trimethylhexanamide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,297 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,298 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,299 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.227.442","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['1154308-86-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[43501033]; selected_pubchem_cids=[43501033]; 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 |
| 252,384 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | rdkit_pre_consensus from 'CC(CC(=O)NCCO)CC(C)(C)C'; added: molecular_mass, monoisotopic_mass |
| 269,297 | consensus_match | altLabel | [] | [{"@value":"Hexanamide, <em>N</em>-(2-hydroxyethyl)-3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":… | group_key=n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide||dimension=Environmental > media=Air > strata=Unknown; cas=1154308-86-7; added Common Chemistry CAS names as altLabel: Hexanamide, <em>N</em>-(2-hydroxyethyl)-3,5,5-trimethyl-; object_uuid=fo-73c43c795bb2c9a5 |
| 269,298 | consensus_match | cas_match_labels | — | {"1154308-86-7":"exactMatch"} | group_key=n-(2-hydroxyethyl)-3,5,5-trimethylhexanamide||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'1154308-86-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-73c43c795bb2c9a5: {'1154308-86-7': 'exactMatch'} |
| 277,578 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'N-(2-hydroxyethyl)-3,5,5-trimethylhexanamide' |
| 284,274 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | rdkit_post_consensus from 'CC(CC(=O)NCCO)CC(C)(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 351,709 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9a46d290-b47f-… | associations resolved on the elementary layer |
| 391,932 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H23NO2"… | typed the way the ontology types it |
| 400,184 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260822T0600486828500000/14933 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v0 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v1 |
| ef:activity/change/20260822T0600486828500000/14934 | name | ef:agent/bootstrap_labels | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v1 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v2 |
| ef:activity/change/20260822T0600486828500000/14935 | synonyms | ef:agent/bootstrap_labels | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v2 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v3 |
| ef:activity/change/20260822T0600486828500000/141416 | context | ef:agent/default_context_mapping | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v3 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v4 |
| ef:activity/change/20260822T0600486828500000/141417 | context_iri | ef:agent/default_context_mapping | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v4 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v5 |
| ef:activity/change/20260822T0600486828500000/218259 | unit_iri | ef:agent/unit_normalization | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v5 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v6 |
| ef:activity/change/20260822T0600486828500000/224536 | prefLabel | ef:agent/normalize_name_case | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v6 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v7 |
| ef:activity/change/20260822T0600486828500000/241297 | properties | ef:agent/enrich_references | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v7 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v8 |
| ef:activity/change/20260822T0600486828500000/241298 | skos_definition | ef:agent/enrich_references | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v8 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v9 |
| ef:activity/change/20260822T0600486828500000/241299 | references | ef:agent/enrich_references | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v9 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v10 |
| ef:activity/change/20260822T0600486828500000/252384 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v10 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v11 |
| ef:activity/change/20260822T0600486828500000/269297 | altLabel | ef:agent/consensus_match | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v11 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v12 |
| ef:activity/change/20260822T0600486828500000/269298 | cas_match_labels | ef:agent/consensus_match | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v12 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v13 |
| ef:activity/change/20260822T0600486828500000/277578 | properties | ef:agent/opsin_iupac | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v13 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v14 |
| ef:activity/change/20260822T0600486828500000/284274 | properties | ef:agent/rdkit_post_consensus | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v14 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v15 |
| ef:activity/change/20260822T0600486828500000/351709 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v15 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v16 |
| ef:activity/change/20260822T0600486828500000/391932 | properties | ef:agent/normalise_property_values | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v16 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v17 |
| ef:activity/change/20260822T0600486828500000/400184 | types | ef:agent/link_flows_to_their_substance | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v17 | ef:flow/9a46d290-b47f-40c1-86b2-22532fc2d60e/v18 |