Benzenesulfonic acid
Everything that changed this flow. Back to the flow
c2c490a4-88e4-4d8f-a911-f90c69820d21
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'BW 70' (grade code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=98-11-3; cc_chebi_agreed_name='Benzenesulfonic acid'; object_uuid=fo-0c4e1bfe75ad05e3 |
| cas_match_labels | 1 | consensus_match | group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-11-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0c4e1bfe75ad05e3: {'98-11-3': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['98-11-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_64455']; candidate_pubchem_cids=[7371, 15619088]; selected_pubchem_cids=[7371]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,543 | bootstrap_labels | prefLabel | — | [{"@value":"benzenesulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Bootstrapped prefLabel from legacy name field |
| 5,544 | bootstrap_labels | name | benzenesulphonic acid | — | Purged legacy name field to enforce prefLabel usage |
| 5,545 | bootstrap_labels | synonyms | ["17-120A","AC1L1OLY","AC1Q1HHT","B0030","B2678","B3408","BENZENESULFONIC ACID","Benzene sulfonic acid","Benzene sulpho… | [] | Removed legacy synonyms field in favor of structured labels |
| 165,120 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 165,121 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 215,190 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,380 | normalize_name_case | prefLabel | [{"@value":"benzenesulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | [{"@value":"Benzenesulphonic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,510 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,511 | enrich_references | skos_definition | — | [{"@value":"The simplest member of the class of a benzenesulfonic acids that consists of a benzene carrying a single su… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,512 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J62.182J","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['98-11-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_64455']; candidate_pubchem_cids=[7371, 15619088]; selected_pubchem_cids=[7371]; 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 |
| 249,848 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | rdkit_pre_consensus from 'C1=CC=C(C=C1)S(=O)(=O)O'; added: monoisotopic_mass |
| 255,074 | chebi_altlabels | altLabel | [] | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | Added 4 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 264,110 | consensus_match | prefLabel | [{"@value":"Benzenesulphonic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | [{"@value":"Benzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | cas=98-11-3; cc_chebi_agreed_name='Benzenesulfonic acid'; object_uuid=fo-0c4e1bfe75ad05e3 |
| 264,111 | consensus_match | altLabel | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | cas=98-11-3; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-0c4e1bfe75ad05e3 |
| 264,112 | consensus_match | altLabel | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; cas=98-11-3; added Common Chemistry CAS names as altLabel: 17-120A, 1: PN: WO2020008043 SEQID: 105 claimed sequence, Alkylbenzenesulfonate, BSA, BW 70, Benzenesulfonic acid (surfactant), Benzensulfonic acid, Nansa 63B; object_uuid=fo-0c4e1bfe75ad05e3 |
| 264,113 | consensus_match | cas_match_labels | — | {"98-11-3":"exactMatch"} | group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-11-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0c4e1bfe75ad05e3: {'98-11-3': 'exactMatch'} |
| 274,987 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Benzenesulfonic acid' |
| 281,471 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | rdkit_post_consensus from 'O=S(=O)(O)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,383 | strip_catalogue_altlabels | altLabel | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | [{"@value":"Benzene sulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | Removed 1 catalogue altLabel value(s): 'BW 70' (grade code) |
| 363,586 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c2c490a4-88e4-… | associations resolved on the elementary layer |
| 389,295 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6O3S"],… | typed the way the ontology types it |
| 396,380 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260821T1554374006150000/5543 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v0 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v1 |
| ef:activity/change/20260821T1554374006150000/5544 | name | ef:agent/bootstrap_labels | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v1 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v2 |
| ef:activity/change/20260821T1554374006150000/5545 | synonyms | ef:agent/bootstrap_labels | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v2 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v3 |
| ef:activity/change/20260821T1554374006150000/165120 | context | ef:agent/default_context_mapping | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v3 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v4 |
| ef:activity/change/20260821T1554374006150000/165121 | context_iri | ef:agent/default_context_mapping | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v4 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v5 |
| ef:activity/change/20260821T1554374006150000/215190 | unit_iri | ef:agent/unit_normalization | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v5 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v6 |
| ef:activity/change/20260821T1554374006150000/222380 | prefLabel | ef:agent/normalize_name_case | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v6 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v7 |
| ef:activity/change/20260821T1554374006150000/232510 | properties | ef:agent/enrich_references | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v7 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v8 |
| ef:activity/change/20260821T1554374006150000/232511 | skos_definition | ef:agent/enrich_references | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v8 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v9 |
| ef:activity/change/20260821T1554374006150000/232512 | references | ef:agent/enrich_references | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v9 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v10 |
| ef:activity/change/20260821T1554374006150000/249848 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v10 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v11 |
| ef:activity/change/20260821T1554374006150000/255074 | altLabel | ef:agent/chebi_altlabels | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v11 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v12 |
| ef:activity/change/20260821T1554374006150000/264110 | prefLabel | ef:agent/consensus_match | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v12 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v13 |
| ef:activity/change/20260821T1554374006150000/264111 | altLabel | ef:agent/consensus_match | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v13 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v14 |
| ef:activity/change/20260821T1554374006150000/264112 | altLabel | ef:agent/consensus_match | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v14 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v15 |
| ef:activity/change/20260821T1554374006150000/264113 | cas_match_labels | ef:agent/consensus_match | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v15 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v16 |
| ef:activity/change/20260821T1554374006150000/274987 | properties | ef:agent/opsin_iupac | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v16 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v17 |
| ef:activity/change/20260821T1554374006150000/281471 | properties | ef:agent/rdkit_post_consensus | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v17 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v18 |
| ef:activity/change/20260821T1554374006150000/288383 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v18 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v19 |
| ef:activity/change/20260821T1554374006150000/363586 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v19 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v20 |
| ef:activity/change/20260821T1554374006150000/389295 | properties | ef:agent/normalise_property_values | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v20 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v21 |
| ef:activity/change/20260821T1554374006150000/396380 | types | ef:agent/link_flows_to_their_substance | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v21 | ef:flow/c2c490a4-88e4-4d8f-a911-f90c69820d21/v22 |