Potassium Dimethyldithiocarbamate
Everything that changed this flow. Back to the flow
0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'MBC 350' (grade 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=potassiumdimethyldithiocarbamate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'128-03-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9ff8c24678fbc01b: {'128-03-0': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['128-03-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[3566770, 23662387, 88798005]; selected_pubchem_cids=[88798005]; 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 |
|---|---|---|---|---|---|
| 11,957 | bootstrap_labels | prefLabel | — | [{"@value":"potassium dimethyldithiocarbamate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Bootstrapped prefLabel from legacy name field |
| 11,958 | bootstrap_labels | name | potassium dimethyldithiocarbamate | — | Purged legacy name field to enforce prefLabel usage |
| 11,959 | bootstrap_labels | synonyms | ["Busan 85","Carbamic acid, dimethyldithio-, potassium salt, hydrate","Carbamodithioic acid, N,N-dimethyl-, potassium s… | [] | Removed legacy synonyms field in favor of structured labels |
| 45,734 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 45,735 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 217,302 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,867 | normalize_name_case | prefLabel | [{"@value":"potassium dimethyldithiocarbamate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | [{"@value":"Potassium Dimethyldithiocarbamate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 238,553 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7KNS2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 238,554 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,555 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=128-03-0","provenance":{"prov:wasGeneratedBy":"enrich_references… | Added references with provenance; cas_numbers=['128-03-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[3566770, 23662387, 88798005]; selected_pubchem_cids=[88798005]; 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 |
| 251,585 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7KNS2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7KNS2"]… | rdkit_pre_consensus from 'CN(C)C(=S)S.[K]'; added: molecular_mass, monoisotopic_mass |
| 270,862 | consensus_match | altLabel | [] | [{"@value":"Arylane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | group_key=potassiumdimethyldithiocarbamate||dimension=Environmental > media=Air > strata=Unknown; cas=128-03-0; added Common Chemistry CAS names as altLabel: Arylane, Busan 85, Carbamic acid, dimethyldithio-, potassium salt, Carbamodithioic acid, <em>N</em>,<em>N</em>-dimethyl-, potassium salt (1:1), Carbamodithioic acid, dimethyl-, potassium salt, MBC 350, Potassium <em>N</em>,<em>N</em>-dimethyldithiocarbamate; object_uuid=fo-9ff8c24678fbc01b |
| 270,863 | consensus_match | cas_match_labels | — | {"128-03-0":"exactMatch"} | group_key=potassiumdimethyldithiocarbamate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'128-03-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9ff8c24678fbc01b: {'128-03-0': 'exactMatch'} |
| 276,767 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7KNS2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7KNS2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Potassium Dimethyldithiocarbamate' |
| 283,403 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7KNS2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6KNS2",… | rdkit_post_consensus from 'CN(C)C(=S)[S-].[K+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,981 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6KNS2",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6KNS2",… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 289,714 | strip_catalogue_altlabels | altLabel | [{"@value":"Arylane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | [{"@value":"Arylane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | Removed 1 catalogue altLabel value(s): 'MBC 350' (grade code) |
| 303,893 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0e2b85af-6de1-… | associations resolved on the elementary layer |
| 399,022 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1554374006150000/11957 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v0 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v1 |
| ef:activity/change/20260821T1554374006150000/11958 | name | ef:agent/bootstrap_labels | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v1 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v2 |
| ef:activity/change/20260821T1554374006150000/11959 | synonyms | ef:agent/bootstrap_labels | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v2 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v3 |
| ef:activity/change/20260821T1554374006150000/45734 | context | ef:agent/default_context_mapping | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v3 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v4 |
| ef:activity/change/20260821T1554374006150000/45735 | context_iri | ef:agent/default_context_mapping | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v4 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v5 |
| ef:activity/change/20260821T1554374006150000/217302 | unit_iri | ef:agent/unit_normalization | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v5 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v6 |
| ef:activity/change/20260821T1554374006150000/223867 | prefLabel | ef:agent/normalize_name_case | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v6 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v7 |
| ef:activity/change/20260821T1554374006150000/238553 | properties | ef:agent/enrich_references | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v7 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v8 |
| ef:activity/change/20260821T1554374006150000/238554 | skos_definition | ef:agent/enrich_references | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v8 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v9 |
| ef:activity/change/20260821T1554374006150000/238555 | references | ef:agent/enrich_references | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v9 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v10 |
| ef:activity/change/20260821T1554374006150000/251585 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v10 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v11 |
| ef:activity/change/20260821T1554374006150000/270862 | altLabel | ef:agent/consensus_match | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v11 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v12 |
| ef:activity/change/20260821T1554374006150000/270863 | cas_match_labels | ef:agent/consensus_match | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v12 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v13 |
| ef:activity/change/20260821T1554374006150000/276767 | properties | ef:agent/opsin_iupac | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v13 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v14 |
| ef:activity/change/20260821T1554374006150000/283403 | properties | ef:agent/rdkit_post_consensus | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v14 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v15 |
| ef:activity/change/20260821T1554374006150000/286981 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v15 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v16 |
| ef:activity/change/20260821T1554374006150000/289714 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v16 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v17 |
| ef:activity/change/20260821T1554374006150000/303893 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v17 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v18 |
| ef:activity/change/20260821T1554374006150000/399022 | types | ef:agent/link_flows_to_their_substance | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v18 | ef:flow/0e2b85af-6de1-4b3c-8fef-36d9dd3c34ff/v19 |