17-acetoxy-1,4,6-pregnatriene-3,20-dione
Everything that changed this flow. Back to the flow
c177726e-080f-4458-9e22-405cc912ba1b
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 | 1 | consensus_match | group_key=17-acetoxy-1,4,6-pregnatriene-3,20-dione||dimension=Environmental > media=Air > indoor=Unknown; cas=2668-75-9; added Common Chemistry CAS names as altLabel: 17-(Acetyloxy)pregna-1,4,6-triene-3,20-dione, 17-Hydroxypregna-1,4,6-triene-3,20-dione acetate, 17α-Acetoxypregna-1,4,6-triene-3,20-dione, Pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-, Pregna-1,4,6-triene-3,20-dione, 17-hydroxy-, acetate; object_uuid=fo-eec8669de5f69051 |
| cas_match_labels | 1 | consensus_match | group_key=17-acetoxy-1,4,6-pregnatriene-3,20-dione||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'2668-75-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eec8669de5f69051: {'2668-75-9': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 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=['2668-75-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[3709675, 11876390, 155887656]; selected_pubchem_cids=[11876390]; 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 |
|---|---|---|---|---|---|
| 15,067 | bootstrap_labels | prefLabel | — | [{"@value":"17-acetoxy-1,4,6-pregnatriene-3,20-dione","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_label… | Bootstrapped prefLabel from legacy name field |
| 15,068 | bootstrap_labels | name | 17-acetoxy-1,4,6-pregnatriene-3,20-dione | — | Purged legacy name field to enforce prefLabel usage |
| 15,069 | bootstrap_labels | synonyms | ["organic","pregna-1,4,6-triene-3,20-dione,17-(acetyloxy)-"] | [] | Removed legacy synonyms field in favor of structured labels |
| 164,404 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 164,405 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 218,303 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,416 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,417 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,418 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=2668-75-9","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['2668-75-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[3709675, 11876390, 155887656]; selected_pubchem_cids=[11876390]; 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 |
| 252,419 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | rdkit_pre_consensus from 'CC(=O)C1(CCC2C1(CCC3C2C=CC4=CC(=O)C=CC34C)C)OC(=O)C'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 259,373 | consensus_match | altLabel | [] | [{"@value":"17-(Acetyloxy)pregna-1,4,6-triene-3,20-dione","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | group_key=17-acetoxy-1,4,6-pregnatriene-3,20-dione||dimension=Environmental > media=Air > indoor=Unknown; cas=2668-75-9; added Common Chemistry CAS names as altLabel: 17-(Acetyloxy)pregna-1,4,6-triene-3,20-dione, 17-Hydroxypregna-1,4,6-triene-3,20-dione acetate, 17α-Acetoxypregna-1,4,6-triene-3,20-dione, Pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-, Pregna-1,4,6-triene-3,20-dione, 17-hydroxy-, acetate; object_uuid=fo-eec8669de5f69051 |
| 259,374 | consensus_match | cas_match_labels | — | {"2668-75-9":"exactMatch"} | group_key=17-acetoxy-1,4,6-pregnatriene-3,20-dione||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'2668-75-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eec8669de5f69051: {'2668-75-9': 'exactMatch'} |
| 277,610 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '17-acetoxy-1,4,6-pregnatriene-3,20-dione' |
| 284,306 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | rdkit_post_consensus from 'CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=CC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@@]21C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 363,221 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c177726e-080f-… | associations resolved on the elementary layer |
| 391,960 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | typed the way the ontology types it |
| 400,227 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 400,228 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H28O4"]… | 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/20260821T0609040591070000/15067 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v0 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v1 |
| ef:activity/change/20260821T0609040591070000/15068 | name | ef:agent/bootstrap_labels | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v1 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v2 |
| ef:activity/change/20260821T0609040591070000/15069 | synonyms | ef:agent/bootstrap_labels | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v2 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v3 |
| ef:activity/change/20260821T0609040591070000/164404 | context | ef:agent/default_context_mapping | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v3 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v4 |
| ef:activity/change/20260821T0609040591070000/164405 | context_iri | ef:agent/default_context_mapping | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v4 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v5 |
| ef:activity/change/20260821T0609040591070000/218303 | unit_iri | ef:agent/unit_normalization | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v5 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v6 |
| ef:activity/change/20260821T0609040591070000/241416 | properties | ef:agent/enrich_references | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v6 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v7 |
| ef:activity/change/20260821T0609040591070000/241417 | skos_definition | ef:agent/enrich_references | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v7 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v8 |
| ef:activity/change/20260821T0609040591070000/241418 | references | ef:agent/enrich_references | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v8 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v9 |
| ef:activity/change/20260821T0609040591070000/252419 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v9 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v10 |
| ef:activity/change/20260821T0609040591070000/259373 | altLabel | ef:agent/consensus_match | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v10 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v11 |
| ef:activity/change/20260821T0609040591070000/259374 | cas_match_labels | ef:agent/consensus_match | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v11 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v12 |
| ef:activity/change/20260821T0609040591070000/277610 | properties | ef:agent/opsin_iupac | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v12 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v13 |
| ef:activity/change/20260821T0609040591070000/284306 | properties | ef:agent/rdkit_post_consensus | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v13 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v14 |
| ef:activity/change/20260821T0609040591070000/363221 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v14 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v15 |
| ef:activity/change/20260821T0609040591070000/391960 | properties | ef:agent/normalise_property_values | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v15 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v16 |
| ef:activity/change/20260821T0609040591070000/400227 | types | ef:agent/link_flows_to_their_substance | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v16 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v17 |
| ef:activity/change/20260821T0609040591070000/400228 | properties | ef:agent/link_flows_to_their_substance | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v17 | ef:flow/c177726e-080f-4458-9e22-405cc912ba1b/v18 |