2,2-dimethyl-3-(morpholin-4-yl)propanal
Everything that changed this flow. Back to the flow
9f5fbabe-b5db-47c3-b9fb-ae7e97535258
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=2,2-dimethyl-3-(morpholin-4-yl)propanal||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'23588-51-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b146c0cd0c171dc9: {'23588-51-4': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['23588-51-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[95475, 3141996]; selected_pubchem_cids=[3141996]; 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 |
|---|---|---|---|---|---|
| 9,537 | bootstrap_labels | prefLabel | — | [{"@value":"2,2-dimethyl-3-(morpholin-4-yl)propanal","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels… | Bootstrapped prefLabel from legacy name field |
| 9,538 | bootstrap_labels | name | 2,2-dimethyl-3-(morpholin-4-yl)propanal | — | Purged legacy name field to enforce prefLabel usage |
| 9,539 | bootstrap_labels | synonyms | ["aldehydem","2,2-dimethyl-3-(morpholin-4-yl)propanal"] | [] | Removed legacy synonyms field in favor of structured labels |
| 144,540 | 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 |
| 144,541 | 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 |
| 216,510 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,297 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,298 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,299 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.857.806I","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['23588-51-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[95475, 3141996]; selected_pubchem_cids=[3141996]; 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 |
| 250,935 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | rdkit_pre_consensus from 'CC(C)(CN1CCOCC1)C=O'; added: molecular_mass, monoisotopic_mass |
| 259,650 | consensus_match | altLabel | [] | [{"@value":"2,2-Dimethyl-3-(<em>N</em>-morpholino)propanal","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | group_key=2,2-dimethyl-3-(morpholin-4-yl)propanal||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=23588-51-4; added Common Chemistry CAS names as altLabel: 2,2-Dimethyl-3-(<em>N</em>-morpholino)propanal, 2,2-Dimethyl-3-(<em>N</em>-morpholinyl)propionaldehyde, 2,2-Dimethyl-3-(morpholino)propanal, 4-Morpholinepropanal, α,α-dimethyl-, 4-Morpholinepropionaldehyde, α,α-dimethyl-, Morpholinopivaldehyde, α,α-Dimethyl-4-morpholinepropanal; object_uuid=fo-b146c0cd0c171dc9 |
| 259,651 | consensus_match | cas_match_labels | — | {"23588-51-4":"exactMatch"} | group_key=2,2-dimethyl-3-(morpholin-4-yl)propanal||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'23588-51-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b146c0cd0c171dc9: {'23588-51-4': 'exactMatch'} |
| 276,121 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,2-dimethyl-3-(morpholin-4-yl)propanal' |
| 282,693 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | rdkit_post_consensus from 'CC(C)(C=O)CN1CCOCC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,444 | dedupe_altlabels | altLabel | [{"@value":"2,2-Dimethyl-3-(<em>N</em>-morpholino)propanal","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | [{"@value":"2,2-Dimethyl-3-(N-morpholino)propanal","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | Deduplicated altLabel values and removed entries matching prefLabel |
| 353,265 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9f5fbabe-b5db-… | associations resolved on the elementary layer |
| 390,458 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2"]… | typed the way the ontology types it |
| 398,079 | 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/20260821T0609040591070000/9537 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v0 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v1 |
| ef:activity/change/20260821T0609040591070000/9538 | name | ef:agent/bootstrap_labels | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v1 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v2 |
| ef:activity/change/20260821T0609040591070000/9539 | synonyms | ef:agent/bootstrap_labels | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v2 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v3 |
| ef:activity/change/20260821T0609040591070000/144540 | context | ef:agent/default_context_mapping | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v3 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v4 |
| ef:activity/change/20260821T0609040591070000/144541 | context_iri | ef:agent/default_context_mapping | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v4 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v5 |
| ef:activity/change/20260821T0609040591070000/216510 | unit_iri | ef:agent/unit_normalization | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v5 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v6 |
| ef:activity/change/20260821T0609040591070000/236297 | properties | ef:agent/enrich_references | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v6 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v7 |
| ef:activity/change/20260821T0609040591070000/236298 | skos_definition | ef:agent/enrich_references | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v7 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v8 |
| ef:activity/change/20260821T0609040591070000/236299 | references | ef:agent/enrich_references | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v8 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v9 |
| ef:activity/change/20260821T0609040591070000/250935 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v9 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v10 |
| ef:activity/change/20260821T0609040591070000/259650 | altLabel | ef:agent/consensus_match | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v10 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v11 |
| ef:activity/change/20260821T0609040591070000/259651 | cas_match_labels | ef:agent/consensus_match | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v11 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v12 |
| ef:activity/change/20260821T0609040591070000/276121 | properties | ef:agent/opsin_iupac | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v12 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v13 |
| ef:activity/change/20260821T0609040591070000/282693 | properties | ef:agent/rdkit_post_consensus | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v13 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v14 |
| ef:activity/change/20260821T0609040591070000/292444 | altLabel | ef:agent/dedupe_altlabels | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v14 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v15 |
| ef:activity/change/20260821T0609040591070000/353265 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v15 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v16 |
| ef:activity/change/20260821T0609040591070000/390458 | properties | ef:agent/normalise_property_values | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v16 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v17 |
| ef:activity/change/20260821T0609040591070000/398079 | types | ef:agent/link_flows_to_their_substance | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v17 | ef:flow/9f5fbabe-b5db-47c3-b9fb-ae7e97535258/v18 |