P-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide
Everything that changed this flow. Back to the flow
38c0b2ab-d33c-4b4e-8b49-9b3579078853
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'33456-68-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-454eb74a69ae2fe8: {'33456-68-7': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['33456-68-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[118080, 122898]; selected_pubchem_cids=[118080]; 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 |
|---|---|---|---|---|---|
| 5,990 | bootstrap_labels | prefLabel | — | [{"@value":"p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide","@language"… | Bootstrapped prefLabel from legacy name field |
| 5,991 | bootstrap_labels | name | p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide | — | Purged legacy name field to enforce prefLabel usage |
| 5,992 | bootstrap_labels | synonyms | ["organic","p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 74,328 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 74,329 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 215,340 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,476 | normalize_name_case | prefLabel | [{"@value":"p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide","@language"… | [{"@value":"P-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide","@language"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,941 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,942 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,943 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J308.490F","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['33456-68-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[118080, 122898]; selected_pubchem_cids=[118080]; 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 |
| 249,976 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | rdkit_pre_consensus from 'CC1(C2=C(C=C(C=C2)OC)C(=O)N(C1=O)CCC3=CC=C(C=C3)S(=O)(=O)N)C'; added: molecular_mass, monoisotopic_mass |
| 270,286 | consensus_match | altLabel | [] | [{"@value":"4-[2-(3,4-Dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1<em>H</em>)-isoquinolinyl)ethyl]benzenesulfonamide","… | group_key=p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide||dimension=Environmental > media=Water > water_body=Long-term; cas=33456-68-7; added Common Chemistry CAS names as altLabel: 4-[2-(3,4-Dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1<em>H</em>)-isoquinolinyl)ethyl]benzenesulfonamide, Benzenesulfonamide, 4-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1<em>H</em>)-isoquinolinyl)ethyl]-, Benzenesulfonamide, <em>p</em>-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1<em>H</em>)-isoquinolyl)ethyl]-; object_uuid=fo-454eb74a69ae2fe8 |
| 270,287 | consensus_match | cas_match_labels | — | {"33456-68-7":"exactMatch"} | group_key=p-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1h)-isoquinolyl)ethyl]benzenesulphonamide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'33456-68-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-454eb74a69ae2fe8: {'33456-68-7': 'exactMatch'} |
| 275,109 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-[2-(3,4-Dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1H)-isoquinolinyl)ethyl]benzenesulfonamide' |
| 281,606 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | rdkit_post_consensus from 'COc1ccc2c(c1)C(=O)N(CCc1ccc(S(N)(=O)=O)cc1)C(=O)C2(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,298 | dedupe_altlabels | altLabel | [{"@value":"4-[2-(3,4-Dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1<em>H</em>)-isoquinolinyl)ethyl]benzenesulfonamide","… | [{"@value":"4-[2-(3,4-Dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1H)-isoquinolinyl)ethyl]benzenesulfonamide","@language… | Deduplicated altLabel values and removed entries matching prefLabel |
| 318,180 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/38c0b2ab-d33c-… | associations resolved on the elementary layer |
| 389,417 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H22N2O5… | typed the way the ontology types it |
| 396,561 | 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/20260821T1554374006150000/5990 | prefLabel | ef:agent/bootstrap_labels | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v0 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v1 |
| ef:activity/change/20260821T1554374006150000/5991 | name | ef:agent/bootstrap_labels | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v1 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v2 |
| ef:activity/change/20260821T1554374006150000/5992 | synonyms | ef:agent/bootstrap_labels | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v2 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v3 |
| ef:activity/change/20260821T1554374006150000/74328 | context | ef:agent/default_context_mapping | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v3 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v4 |
| ef:activity/change/20260821T1554374006150000/74329 | context_iri | ef:agent/default_context_mapping | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v4 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v5 |
| ef:activity/change/20260821T1554374006150000/215340 | unit_iri | ef:agent/unit_normalization | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v5 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v6 |
| ef:activity/change/20260821T1554374006150000/222476 | prefLabel | ef:agent/normalize_name_case | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v6 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v7 |
| ef:activity/change/20260821T1554374006150000/232941 | properties | ef:agent/enrich_references | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v7 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v8 |
| ef:activity/change/20260821T1554374006150000/232942 | skos_definition | ef:agent/enrich_references | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v8 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v9 |
| ef:activity/change/20260821T1554374006150000/232943 | references | ef:agent/enrich_references | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v9 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v10 |
| ef:activity/change/20260821T1554374006150000/249976 | properties | ef:agent/rdkit_pre_consensus | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v10 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v11 |
| ef:activity/change/20260821T1554374006150000/270286 | altLabel | ef:agent/consensus_match | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v11 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v12 |
| ef:activity/change/20260821T1554374006150000/270287 | cas_match_labels | ef:agent/consensus_match | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v12 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v13 |
| ef:activity/change/20260821T1554374006150000/275109 | properties | ef:agent/opsin_iupac | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v13 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v14 |
| ef:activity/change/20260821T1554374006150000/281606 | properties | ef:agent/rdkit_post_consensus | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v14 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v15 |
| ef:activity/change/20260821T1554374006150000/292298 | altLabel | ef:agent/dedupe_altlabels | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v15 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v16 |
| ef:activity/change/20260821T1554374006150000/318180 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v16 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v17 |
| ef:activity/change/20260821T1554374006150000/389417 | properties | ef:agent/normalise_property_values | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v17 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v18 |
| ef:activity/change/20260821T1554374006150000/396561 | types | ef:agent/link_flows_to_their_substance | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v18 | ef:flow/38c0b2ab-d33c-4b4e-8b49-9b3579078853/v19 |