Methyl 2-[(4-hydroxybenzenesulfonyl)oxy]benzoate
Everything that changed this flow. Back to the flow
d17435bb-5d7d-470e-be01-f3b7955d26e7
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=methyl2-[(4-hydroxybenzenesulfonyl)oxy]benzoate||dimension=Environmental > media=Air > strata=Long-term; cas=1432505-97-9; added Common Chemistry CAS names as altLabel: Benzoic acid, 2-[[(4-hydroxyphenyl)sulfonyl]oxy]-, methyl ester, Methyl 2-[[(4-hydroxyphenyl)sulfonyl]oxy]benzoate; object_uuid=fo-a4d075caf29cac71 |
| cas_match_labels | 1 | consensus_match | group_key=methyl2-[(4-hydroxybenzenesulfonyl)oxy]benzoate||dimension=Environmental > media=Air > strata=Long-term; group_sources=[]; cas_sources={'1432505-97-9': []}; assigned CAS labels from group consensus; object_uuid=fo-a4d075caf29cac71: {'1432505-97-9': '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 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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1432505-97-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[102494927]; selected_pubchem_cids=[102494927]; 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 |
|---|---|---|---|---|---|
| 4,113 | bootstrap_labels | prefLabel | — | [{"@value":"methyl 2-[(4-hydroxybenzenesulfonyl)oxy]benzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | Bootstrapped prefLabel from legacy name field |
| 4,114 | bootstrap_labels | name | methyl 2-[(4-hydroxybenzenesulfonyl)oxy]benzoate | — | Purged legacy name field to enforce prefLabel usage |
| 4,115 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 173,920 | 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 |
| 173,921 | 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 |
| 214,714 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,041 | normalize_name_case | prefLabel | [{"@value":"methyl 2-[(4-hydroxybenzenesulfonyl)oxy]benzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | [{"@value":"Methyl 2-[(4-hydroxybenzenesulfonyl)oxy]benzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 231,139 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,140 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,141 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.208.533D","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['1432505-97-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[102494927]; selected_pubchem_cids=[102494927]; 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 |
| 249,455 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | rdkit_pre_consensus from 'COC(=O)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)O'; added: molecular_mass, monoisotopic_mass |
| 268,712 | consensus_match | altLabel | [] | [{"@value":"Benzoic acid, 2-[[(4-hydroxyphenyl)sulfonyl]oxy]-, methyl ester","@language":"en","source":{"prov:wasGenera… | group_key=methyl2-[(4-hydroxybenzenesulfonyl)oxy]benzoate||dimension=Environmental > media=Air > strata=Long-term; cas=1432505-97-9; added Common Chemistry CAS names as altLabel: Benzoic acid, 2-[[(4-hydroxyphenyl)sulfonyl]oxy]-, methyl ester, Methyl 2-[[(4-hydroxyphenyl)sulfonyl]oxy]benzoate; object_uuid=fo-a4d075caf29cac71 |
| 268,713 | consensus_match | cas_match_labels | — | {"1432505-97-9":"exactMatch"} | group_key=methyl2-[(4-hydroxybenzenesulfonyl)oxy]benzoate||dimension=Environmental > media=Air > strata=Long-term; group_sources=[]; cas_sources={'1432505-97-9': []}; assigned CAS labels from group consensus; object_uuid=fo-a4d075caf29cac71: {'1432505-97-9': 'exactMatch'} |
| 274,588 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Methyl 2-[(4-hydroxybenzenesulfonyl)oxy]benzoate' |
| 281,040 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | rdkit_post_consensus from 'COC(=O)c1ccccc1OS(=O)(=O)c1ccc(O)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 367,984 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d17435bb-5d7d-… | associations resolved on the elementary layer |
| 388,896 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H12O6S"… | typed the way the ontology types it |
| 395,824 | 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/20260822T0600486828500000/4113 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v0 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v1 |
| ef:activity/change/20260822T0600486828500000/4114 | name | ef:agent/bootstrap_labels | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v1 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v2 |
| ef:activity/change/20260822T0600486828500000/4115 | synonyms | ef:agent/bootstrap_labels | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v2 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v3 |
| ef:activity/change/20260822T0600486828500000/173920 | context | ef:agent/default_context_mapping | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v3 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v4 |
| ef:activity/change/20260822T0600486828500000/173921 | context_iri | ef:agent/default_context_mapping | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v4 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v5 |
| ef:activity/change/20260822T0600486828500000/214714 | unit_iri | ef:agent/unit_normalization | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v5 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v6 |
| ef:activity/change/20260822T0600486828500000/222041 | prefLabel | ef:agent/normalize_name_case | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v6 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v7 |
| ef:activity/change/20260822T0600486828500000/231139 | properties | ef:agent/enrich_references | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v7 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v8 |
| ef:activity/change/20260822T0600486828500000/231140 | skos_definition | ef:agent/enrich_references | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v8 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v9 |
| ef:activity/change/20260822T0600486828500000/231141 | references | ef:agent/enrich_references | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v9 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v10 |
| ef:activity/change/20260822T0600486828500000/249455 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v10 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v11 |
| ef:activity/change/20260822T0600486828500000/268712 | altLabel | ef:agent/consensus_match | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v11 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v12 |
| ef:activity/change/20260822T0600486828500000/268713 | cas_match_labels | ef:agent/consensus_match | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v12 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v13 |
| ef:activity/change/20260822T0600486828500000/274588 | properties | ef:agent/opsin_iupac | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v13 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v14 |
| ef:activity/change/20260822T0600486828500000/281040 | properties | ef:agent/rdkit_post_consensus | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v14 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v15 |
| ef:activity/change/20260822T0600486828500000/367984 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v15 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v16 |
| ef:activity/change/20260822T0600486828500000/388896 | properties | ef:agent/normalise_property_values | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v16 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v17 |
| ef:activity/change/20260822T0600486828500000/395824 | types | ef:agent/link_flows_to_their_substance | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v17 | ef:flow/d17435bb-5d7d-470e-be01-f3b7955d26e7/v18 |