1,3-benzodioxole-5-carbaldehyde
Everything that changed this flow. Back to the flow
7903bfcc-3678-4369-a87b-1509e64ef2f8
By field
14 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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 26826' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1,3-benzodioxole-5-carbaldehyde||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'120-57-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3d8fa3f38f802142: {'120-57-0': '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=['120-57-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_8240']; candidate_pubchem_cids=[8438, 70991]; selected_pubchem_cids=[8438]; 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 |
| roles | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| 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 |
|---|---|---|---|---|---|
| 16,178 | bootstrap_labels | prefLabel | — | [{"@value":"1,3-benzodioxole-5-carbaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 16,179 | bootstrap_labels | name | 1,3-benzodioxole-5-carbaldehyde | — | Purged legacy name field to enforce prefLabel usage |
| 16,180 | bootstrap_labels | synonyms | ["organic","piperonal","heliotropin","heliotropine"] | [] | Removed legacy synonyms field in favor of structured labels |
| 121,780 | 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 |
| 121,781 | 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 |
| 218,657 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 242,408 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 242,409 | enrich_references | skos_definition | — | [{"@value":"An arenecarbaldehyde that is 1,3-benzodioxole substituted by a formyl substituent at position 5. It has bee… | Merged ChEBI/PubChem definitions into skos:definition |
| 242,410 | enrich_references | references | [] | [{"@id":"gmelin:4186","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"conse… | Added references with provenance; cas_numbers=['120-57-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_8240']; candidate_pubchem_cids=[8438, 70991]; selected_pubchem_cids=[8438]; 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 |
| 252,715 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | rdkit_pre_consensus from 'C1OC2=C(O1)C=C(C=C2)C=O'; added: monoisotopic_mass |
| 256,535 | chebi_altlabels | altLabel | [] | [{"@value":"1,3-benzodioxole-5-carboxaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | Added 13 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 258,520 | consensus_match | altLabel | [{"@value":"1,3-benzodioxole-5-carboxaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | [{"@value":"1,3-benzodioxole-5-carboxaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | group_key=1,3-benzodioxole-5-carbaldehyde||dimension=Environmental > media=Air > strata=Long-term; cas=120-57-0; added Common Chemistry CAS names as altLabel: 2<em>H</em>-1,3-Benzodioxole-5-carbaldehyde, 2<em>H</em>-1,3-Benzodioxole-5-carboxaldehyde, 2<em>H</em>-Benzo[3,4-<em>d</em>]-1,3-dioxolan-5-ylformaldehyde, 3,4-Dimethylenedioxybenzaldehyde, 5-Formyl-1,3-benzodioxolane, 5-Formylbenzodioxole, Benzo[1,3]dioxole-5-carbaldehyde, Benzo[<em>d</em>][1,3]dioxol-5-carboxaldehyde, Benzo[<em>d</em>][1,3]dioxole-5-carbaldehyde, Benzo[<em>d</em>][1,3]dioxole-5-carboxaldehyde, Geliotropin, NSC 26826; object_uuid=fo-3d8fa3f38f802142 |
| 258,521 | consensus_match | cas_match_labels | — | {"120-57-0":"exactMatch"} | group_key=1,3-benzodioxole-5-carbaldehyde||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'120-57-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3d8fa3f38f802142: {'120-57-0': 'exactMatch'} |
| 277,936 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3-benzodioxole-5-carbaldehyde' |
| 284,648 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | rdkit_post_consensus from 'O=Cc1ccc2c(c1)OCO2'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,561 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3-benzodioxole-5-carboxaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | [{"@value":"1,3-benzodioxole-5-carboxaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | Removed 1 catalogue altLabel value(s): 'NSC 26826' (registry code) |
| 341,908 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7903bfcc-3678-… | associations resolved on the elementary layer |
| 392,289 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H6O3"],"… | typed the way the ontology types it |
| 400,670 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 400,671 | link_flows_to_their_substance | roles | — | [{"@id":"http://purl.obolibrary.org/obo/CHEBI_24852","rdfs:label":"insecticide","http://www.w3.org/2004/02/skos/core#de… | 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/20260820T1416470405690000/16178 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v0 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v1 |
| ef:activity/change/20260820T1416470405690000/16179 | name | ef:agent/bootstrap_labels | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v1 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v2 |
| ef:activity/change/20260820T1416470405690000/16180 | synonyms | ef:agent/bootstrap_labels | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v2 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v3 |
| ef:activity/change/20260820T1416470405690000/121780 | context | ef:agent/default_context_mapping | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v3 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v4 |
| ef:activity/change/20260820T1416470405690000/121781 | context_iri | ef:agent/default_context_mapping | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v4 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v5 |
| ef:activity/change/20260820T1416470405690000/218657 | unit_iri | ef:agent/unit_normalization | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v5 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v6 |
| ef:activity/change/20260820T1416470405690000/242408 | properties | ef:agent/enrich_references | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v6 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v7 |
| ef:activity/change/20260820T1416470405690000/242409 | skos_definition | ef:agent/enrich_references | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v7 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v8 |
| ef:activity/change/20260820T1416470405690000/242410 | references | ef:agent/enrich_references | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v8 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v9 |
| ef:activity/change/20260820T1416470405690000/252715 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v9 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v10 |
| ef:activity/change/20260820T1416470405690000/256535 | altLabel | ef:agent/chebi_altlabels | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v10 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v11 |
| ef:activity/change/20260820T1416470405690000/258520 | altLabel | ef:agent/consensus_match | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v11 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v12 |
| ef:activity/change/20260820T1416470405690000/258521 | cas_match_labels | ef:agent/consensus_match | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v12 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v13 |
| ef:activity/change/20260820T1416470405690000/277936 | properties | ef:agent/opsin_iupac | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v13 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v14 |
| ef:activity/change/20260820T1416470405690000/284648 | properties | ef:agent/rdkit_post_consensus | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v14 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v15 |
| ef:activity/change/20260820T1416470405690000/290561 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v15 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v16 |
| ef:activity/change/20260820T1416470405690000/341908 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v16 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v17 |
| ef:activity/change/20260820T1416470405690000/392289 | properties | ef:agent/normalise_property_values | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v17 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v18 |
| ef:activity/change/20260820T1416470405690000/400670 | types | ef:agent/link_flows_to_their_substance | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v18 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v19 |
| ef:activity/change/20260820T1416470405690000/400671 | roles | ef:agent/link_flows_to_their_substance | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v19 | ef:flow/7903bfcc-3678-4369-a87b-1509e64ef2f8/v20 |