Selenium Diethyldithiocarbamate
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-9ac0-0050c2490048
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=seleniumdiethyldithiocarbamate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'5456-28-0': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-bf9156010854a5dd: {'5456-28-0': '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 water > Emissions to sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['5456-28-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82466']; candidate_pubchem_cids=[62579, 220802, 257590, 90473926]; selected_pubchem_cids=[62579]; 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 |
|---|---|---|---|---|---|
| 8,402 | bootstrap_labels | prefLabel | — | [{"@value":"selenium diethyldithiocarbamate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 8,403 | bootstrap_labels | name | selenium diethyldithiocarbamate | — | Purged legacy name field to enforce prefLabel usage |
| 8,404 | bootstrap_labels | synonyms | ["3,3-bis{[(diethylamino)carbonothioyl]thio}-N,N,6-triethyl-1,5-dithioxo-2,4-dithia-3lambda~4~-selena-6-azaoctan-1-amin… | [] | Removed legacy synonyms field in favor of structured labels |
| 94,494 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 94,495 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 216,136 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,079 | normalize_name_case | prefLabel | [{"@value":"selenium diethyldithiocarbamate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | [{"@value":"Selenium Diethyldithiocarbamate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 235,208 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 235,209 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 235,210 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.024.285","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['5456-28-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82466']; candidate_pubchem_cids=[62579, 220802, 257590, 90473926]; selected_pubchem_cids=[62579]; 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 |
| 250,621 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | rdkit_pre_consensus from 'CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Se+4]'; added: monoisotopic_mass |
| 271,592 | consensus_match | altLabel | [] | [{"@value":"Carbamodithioic acid, diethyl-, tetrakis(anhydrosulfide) with thioselenious acid (H<sub>4</sub>SeS<sub>4</s… | group_key=seleniumdiethyldithiocarbamate||dimension=Environmental > media=Ground > geography=Agricultural; cas=5456-28-0; added Common Chemistry CAS names as altLabel: Carbamodithioic acid, diethyl-, tetrakis(anhydrosulfide) with thioselenious acid (H<sub>4</sub>SeS<sub>4</sub>), Ethyl Selenac, Selenium tetrakis(<em>N</em>, <em>N</em>-diethyldithiocarbamate), Selenium tetrakis(diethyldithiocarbamate), Selenium, tetrakis(diethylcarbamodithioato-<em>S</em>,<em>S</em>′)-, Selenium, tetrakis(diethylcarbamodithioato-κ<em>S</em>,κ<em>S</em>′)-, Selenium, tetrakis(diethyldithiocarbamato)-, Tetrakis(<em>N</em>,<em>N</em>-diethyldithiocarbamato)selenium; object_uuid=fo-bf9156010854a5dd |
| 271,593 | consensus_match | cas_match_labels | — | {"5456-28-0":"exactMatch"} | group_key=seleniumdiethyldithiocarbamate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'5456-28-0': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-bf9156010854a5dd: {'5456-28-0': 'exactMatch'} |
| 275,791 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Selenium tetrakis(N, N-diethyldithiocarbamate)' |
| 282,348 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | rdkit_post_consensus from 'CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Se+4]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,398 | dedupe_altlabels | altLabel | [{"@value":"Carbamodithioic acid, diethyl-, tetrakis(anhydrosulfide) with thioselenious acid (H<sub>4</sub>SeS<sub>4</s… | [{"@value":"Carbamodithioic acid, diethyl-, tetrakis(anhydrosulfide) with thioselenious acid (H4SeS4)","@language":"en"… | Deduplicated altLabel values and removed entries matching prefLabel |
| 328,249 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 390,130 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C5H10NS2.… | typed the way the ontology types it |
| 397,618 | 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/20260821T1554374006150000/8402 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v1 |
| ef:activity/change/20260821T1554374006150000/8403 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v2 |
| ef:activity/change/20260821T1554374006150000/8404 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v3 |
| ef:activity/change/20260821T1554374006150000/94494 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v4 |
| ef:activity/change/20260821T1554374006150000/94495 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v5 |
| ef:activity/change/20260821T1554374006150000/216136 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v6 |
| ef:activity/change/20260821T1554374006150000/223079 | prefLabel | ef:agent/normalize_name_case | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v7 |
| ef:activity/change/20260821T1554374006150000/235208 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v8 |
| ef:activity/change/20260821T1554374006150000/235209 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v9 |
| ef:activity/change/20260821T1554374006150000/235210 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v10 |
| ef:activity/change/20260821T1554374006150000/250621 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v11 |
| ef:activity/change/20260821T1554374006150000/271592 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v12 |
| ef:activity/change/20260821T1554374006150000/271593 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v13 |
| ef:activity/change/20260821T1554374006150000/275791 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v14 |
| ef:activity/change/20260821T1554374006150000/282348 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v15 |
| ef:activity/change/20260821T1554374006150000/292398 | altLabel | ef:agent/dedupe_altlabels | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v16 |
| ef:activity/change/20260821T1554374006150000/328249 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v17 |
| ef:activity/change/20260821T1554374006150000/390130 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v18 |
| ef:activity/change/20260821T1554374006150000/397618 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-9ac0-0050c2490048/v19 |