2,4-dimethoxybenzaldehyde
Everything that changed this flow. Back to the flow
8403239f-6541-4013-8561-1a75748008cf
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, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 27023' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=2,4-dimethoxybenzaldehyde||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'613-45-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cb0420fe82f0fe33: {'613-45-6': '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 air > Emissions to air, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 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=['613-45-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[69175, 279060]; selected_pubchem_cids=[69175]; 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 |
|---|---|---|---|---|---|
| 3,113 | bootstrap_labels | prefLabel | — | [{"@value":"2,4-dimethoxybenzaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Bootstrapped prefLabel from legacy name field |
| 3,114 | bootstrap_labels | name | 2,4-dimethoxybenzaldehyde | — | Purged legacy name field to enforce prefLabel usage |
| 3,115 | bootstrap_labels | synonyms | ["2,4-bis(methyloxy)benzaldehyde","AC-10536","AC1L2BAA","AC1Q490F","AC1Q6Q7G","AK-087/40243220","AKOS000118830","Benzal… | [] | Removed legacy synonyms field in favor of structured labels |
| 128,290 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 128,291 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 214,378 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 230,171 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 230,172 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 230,173 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J79.736G","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['613-45-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[69175, 279060]; selected_pubchem_cids=[69175]; 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 |
| 249,183 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | rdkit_pre_consensus from 'COC1=CC(=C(C=C1)C=O)OC'; added: molecular_mass, monoisotopic_mass |
| 259,956 | consensus_match | altLabel | [] | [{"@value":"Benzaldehyde, 2,4-dimethoxy-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | group_key=2,4-dimethoxybenzaldehyde||dimension=Environmental > media=Ground > geography=Unknown; cas=613-45-6; added Common Chemistry CAS names as altLabel: Benzaldehyde, 2,4-dimethoxy-, NSC 27023; object_uuid=fo-cb0420fe82f0fe33 |
| 259,957 | consensus_match | cas_match_labels | — | {"613-45-6":"exactMatch"} | group_key=2,4-dimethoxybenzaldehyde||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'613-45-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cb0420fe82f0fe33: {'613-45-6': 'exactMatch'} |
| 274,296 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,4-dimethoxybenzaldehyde' |
| 280,723 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | rdkit_post_consensus from 'COc1ccc(C=O)c(OC)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,861 | strip_catalogue_altlabels | altLabel | [{"@value":"Benzaldehyde, 2,4-dimethoxy-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | [{"@value":"Benzaldehyde, 2,4-dimethoxy-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | Removed 1 catalogue altLabel value(s): 'NSC 27023' (registry code) |
| 345,140 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8403239f-6541-… | associations resolved on the elementary layer |
| 388,587 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H10O3"],… | typed the way the ontology types it |
| 395,389 | 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/20260821T0609040591070000/3113 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v0 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v1 |
| ef:activity/change/20260821T0609040591070000/3114 | name | ef:agent/bootstrap_labels | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v1 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v2 |
| ef:activity/change/20260821T0609040591070000/3115 | synonyms | ef:agent/bootstrap_labels | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v2 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v3 |
| ef:activity/change/20260821T0609040591070000/128290 | context | ef:agent/default_context_mapping | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v3 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v4 |
| ef:activity/change/20260821T0609040591070000/128291 | context_iri | ef:agent/default_context_mapping | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v4 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v5 |
| ef:activity/change/20260821T0609040591070000/214378 | unit_iri | ef:agent/unit_normalization | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v5 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v6 |
| ef:activity/change/20260821T0609040591070000/230171 | properties | ef:agent/enrich_references | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v6 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v7 |
| ef:activity/change/20260821T0609040591070000/230172 | skos_definition | ef:agent/enrich_references | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v7 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v8 |
| ef:activity/change/20260821T0609040591070000/230173 | references | ef:agent/enrich_references | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v8 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v9 |
| ef:activity/change/20260821T0609040591070000/249183 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v9 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v10 |
| ef:activity/change/20260821T0609040591070000/259956 | altLabel | ef:agent/consensus_match | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v10 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v11 |
| ef:activity/change/20260821T0609040591070000/259957 | cas_match_labels | ef:agent/consensus_match | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v11 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v12 |
| ef:activity/change/20260821T0609040591070000/274296 | properties | ef:agent/opsin_iupac | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v12 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v13 |
| ef:activity/change/20260821T0609040591070000/280723 | properties | ef:agent/rdkit_post_consensus | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v13 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v14 |
| ef:activity/change/20260821T0609040591070000/287861 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v14 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v15 |
| ef:activity/change/20260821T0609040591070000/345140 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v15 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v16 |
| ef:activity/change/20260821T0609040591070000/388587 | properties | ef:agent/normalise_property_values | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v16 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v17 |
| ef:activity/change/20260821T0609040591070000/395389 | types | ef:agent/link_flows_to_their_substance | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v17 | ef:flow/8403239f-6541-4013-8561-1a75748008cf/v18 |