6-[[(4-methylphenyl)sulphonyl]amino]hexanoic Acid
Everything that changed this flow. Back to the flow
8cd84f76-0a82-42ed-b203-e8b4a150735f
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 38047' (registry code) |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=6-[[(4-methylphenyl)sulphonyl]amino]hexanoicacid||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'78521-39-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-942c8feeb18aacd2: {'78521-39-8': '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 agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['78521-39-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[95822]; selected_pubchem_cids=[95822]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 14,950 | bootstrap_labels | prefLabel | — | [{"@value":"6-[[(4-methylphenyl)sulphonyl]amino]hexanoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Bootstrapped prefLabel from legacy name field |
| 14,951 | bootstrap_labels | name | 6-[[(4-methylphenyl)sulphonyl]amino]hexanoic acid | — | Purged legacy name field to enforce prefLabel usage |
| 14,952 | bootstrap_labels | synonyms | ["organic","6-[[(4-methylphenyl)sulphonyl]amino]hexanoicacid","ascplus","ascplus,dried","asc+","asc-plus,dried"] | [] | Removed legacy synonyms field in favor of structured labels |
| 133,618 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 133,619 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 218,264 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,540 | normalize_name_case | prefLabel | [{"@value":"6-[[(4-methylphenyl)sulphonyl]amino]hexanoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | [{"@value":"6-[[(4-methylphenyl)sulphonyl]amino]hexanoic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,312 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,313 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,314 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J319.779D","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['78521-39-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[95822]; selected_pubchem_cids=[95822]; 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 |
| 252,389 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | rdkit_pre_consensus from 'CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)O'; added: molecular_mass, monoisotopic_mass |
| 263,216 | consensus_match | altLabel | [] | [{"@value":"6-[(4-Methylbenzenesulfonyl)amino]caproic acid","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | group_key=6-[[(4-methylphenyl)sulphonyl]amino]hexanoicacid||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=78521-39-8; added Common Chemistry CAS names as altLabel: 6-[(4-Methylbenzenesulfonyl)amino]caproic acid, 6-[[(4-Methylphenyl)sulfonyl]amino]hexanoic acid, Hexanoic acid, 6-<em>p</em>-toluenesulfonamido-, Hexanoic acid, 6-[[(4-methylphenyl)sulfonyl]amino]-, NSC 38047; object_uuid=fo-942c8feeb18aacd2 |
| 263,217 | consensus_match | cas_match_labels | — | {"78521-39-8":"exactMatch"} | group_key=6-[[(4-methylphenyl)sulphonyl]amino]hexanoicacid||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'78521-39-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-942c8feeb18aacd2: {'78521-39-8': 'exactMatch'} |
| 277,583 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '6-[[(4-methylphenyl)sulphonyl]amino]hexanoic Acid' |
| 284,279 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | rdkit_post_consensus from 'Cc1ccc(S(=O)(=O)NCCCCCC(=O)O)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,310 | strip_catalogue_altlabels | altLabel | [{"@value":"6-[(4-Methylbenzenesulfonyl)amino]caproic acid","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | [{"@value":"6-[(4-Methylbenzenesulfonyl)amino]caproic acid","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | Removed 1 catalogue altLabel value(s): 'NSC 38047' (registry code) |
| 347,805 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8cd84f76-0a82-… | associations resolved on the elementary layer |
| 391,937 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H19NO4S… | typed the way the ontology types it |
| 400,189 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260821T1554374006150000/14950 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v0 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v1 |
| ef:activity/change/20260821T1554374006150000/14951 | name | ef:agent/bootstrap_labels | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v1 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v2 |
| ef:activity/change/20260821T1554374006150000/14952 | synonyms | ef:agent/bootstrap_labels | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v2 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v3 |
| ef:activity/change/20260821T1554374006150000/133618 | context | ef:agent/default_context_mapping | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v3 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v4 |
| ef:activity/change/20260821T1554374006150000/133619 | context_iri | ef:agent/default_context_mapping | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v4 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v5 |
| ef:activity/change/20260821T1554374006150000/218264 | unit_iri | ef:agent/unit_normalization | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v5 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v6 |
| ef:activity/change/20260821T1554374006150000/224540 | prefLabel | ef:agent/normalize_name_case | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v6 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v7 |
| ef:activity/change/20260821T1554374006150000/241312 | properties | ef:agent/enrich_references | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v7 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v8 |
| ef:activity/change/20260821T1554374006150000/241313 | skos_definition | ef:agent/enrich_references | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v8 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v9 |
| ef:activity/change/20260821T1554374006150000/241314 | references | ef:agent/enrich_references | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v9 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v10 |
| ef:activity/change/20260821T1554374006150000/252389 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v10 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v11 |
| ef:activity/change/20260821T1554374006150000/263216 | altLabel | ef:agent/consensus_match | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v11 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v12 |
| ef:activity/change/20260821T1554374006150000/263217 | cas_match_labels | ef:agent/consensus_match | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v12 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v13 |
| ef:activity/change/20260821T1554374006150000/277583 | properties | ef:agent/opsin_iupac | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v13 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v14 |
| ef:activity/change/20260821T1554374006150000/284279 | properties | ef:agent/rdkit_post_consensus | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v14 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v15 |
| ef:activity/change/20260821T1554374006150000/290310 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v15 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v16 |
| ef:activity/change/20260821T1554374006150000/347805 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v16 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v17 |
| ef:activity/change/20260821T1554374006150000/391937 | properties | ef:agent/normalise_property_values | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v17 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v18 |
| ef:activity/change/20260821T1554374006150000/400189 | types | ef:agent/link_flows_to_their_substance | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v18 | ef:flow/8cd84f76-0a82-42ed-b203-e8b4a150735f/v19 |