Isothioate
Everything that changed this flow. Back to the flow
3191873c-df0b-44ce-a75e-cfd0596c8bec
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=isothioate||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'36614-38-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-42f5ff5aed049545: {'36614-38-7': '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, unspecified (long-term) |
| 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 (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['36614-38-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[37490]; selected_pubchem_cids=[37490]; 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 |
|---|---|---|---|---|---|
| 3,104 | bootstrap_labels | prefLabel | — | [{"@value":"isothioate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | Bootstrapped prefLabel from legacy name field |
| 3,105 | bootstrap_labels | name | isothioate | — | Purged legacy name field to enforce prefLabel usage |
| 3,106 | bootstrap_labels | synonyms | ["AC1L1XU5","Hodson","Hosalon","Hosdon","Hosdon granule","Isothioate [BSI:ISO]","Isothionate","O,O-Dimethyl S-((2-isopr… | [] | Removed legacy synonyms field in favor of structured labels |
| 69,462 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 69,463 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 214,375 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,799 | normalize_name_case | prefLabel | [{"@value":"isothioate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | [{"@value":"Isothioate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 230,162 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 230,163 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 230,164 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.812A","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['36614-38-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[37490]; selected_pubchem_cids=[37490]; 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 |
| 249,180 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | rdkit_pre_consensus from 'CC(C)SCCSP(=S)(OC)OC'; added: molecular_mass, monoisotopic_mass |
| 268,219 | consensus_match | altLabel | [] | [{"@value":"<em>O</em>,<em>O</em>-Dimethyl <em>S</em>-[2-(isopropylthio)ethyl] phosphorodithioate","@language":"en","so… | group_key=isothioate||dimension=Environmental > media=Air > indoor=Unknown; cas=36614-38-7; added Common Chemistry CAS names as altLabel: <em>O</em>,<em>O</em>-Dimethyl <em>S</em>-[2-(isopropylthio)ethyl] phosphorodithioate, <em>S</em>-(2-Isopropylthioethyl) <em>O</em>,<em>O</em>-dimethyl phosphorodithioate, Hosalon, Hosdon, Phosphorodithioic acid, <em>O</em>,<em>O</em>-dimethyl <em>S</em>-[2-[(1-methylethyl)thio]ethyl] ester; object_uuid=fo-42f5ff5aed049545 |
| 268,220 | consensus_match | cas_match_labels | — | {"36614-38-7":"exactMatch"} | group_key=isothioate||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'36614-38-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-42f5ff5aed049545: {'36614-38-7': 'exactMatch'} |
| 274,293 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'O,O-Dimethyl S-[2-(isopropylthio)ethyl] phosphorodithioate' |
| 280,725 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | rdkit_post_consensus from 'COP(=S)(OC)SCCSC(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,148 | dedupe_altlabels | altLabel | [{"@value":"<em>O</em>,<em>O</em>-Dimethyl <em>S</em>-[2-(isopropylthio)ethyl] phosphorodithioate","@language":"en","so… | [{"@value":"O,O-Dimethyl S-[2-(isopropylthio)ethyl] phosphorodithioate","@language":"en","source":{"prov:wasGeneratedBy… | Deduplicated altLabel values and removed entries matching prefLabel |
| 315,748 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/3191873c-df0b-… | associations resolved on the elementary layer |
| 388,591 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H17O2PS3… | typed the way the ontology types it |
| 395,395 | 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/20260822T0600486828500000/3104 | prefLabel | ef:agent/bootstrap_labels | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v0 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v1 |
| ef:activity/change/20260822T0600486828500000/3105 | name | ef:agent/bootstrap_labels | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v1 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v2 |
| ef:activity/change/20260822T0600486828500000/3106 | synonyms | ef:agent/bootstrap_labels | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v2 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v3 |
| ef:activity/change/20260822T0600486828500000/69462 | context | ef:agent/default_context_mapping | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v3 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v4 |
| ef:activity/change/20260822T0600486828500000/69463 | context_iri | ef:agent/default_context_mapping | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v4 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v5 |
| ef:activity/change/20260822T0600486828500000/214375 | unit_iri | ef:agent/unit_normalization | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v5 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v6 |
| ef:activity/change/20260822T0600486828500000/221799 | prefLabel | ef:agent/normalize_name_case | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v6 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v7 |
| ef:activity/change/20260822T0600486828500000/230162 | properties | ef:agent/enrich_references | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v7 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v8 |
| ef:activity/change/20260822T0600486828500000/230163 | skos_definition | ef:agent/enrich_references | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v8 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v9 |
| ef:activity/change/20260822T0600486828500000/230164 | references | ef:agent/enrich_references | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v9 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v10 |
| ef:activity/change/20260822T0600486828500000/249180 | properties | ef:agent/rdkit_pre_consensus | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v10 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v11 |
| ef:activity/change/20260822T0600486828500000/268219 | altLabel | ef:agent/consensus_match | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v11 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v12 |
| ef:activity/change/20260822T0600486828500000/268220 | cas_match_labels | ef:agent/consensus_match | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v12 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v13 |
| ef:activity/change/20260822T0600486828500000/274293 | properties | ef:agent/opsin_iupac | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v13 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v14 |
| ef:activity/change/20260822T0600486828500000/280725 | properties | ef:agent/rdkit_post_consensus | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v14 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v15 |
| ef:activity/change/20260822T0600486828500000/292148 | altLabel | ef:agent/dedupe_altlabels | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v15 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v16 |
| ef:activity/change/20260822T0600486828500000/315748 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v16 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v17 |
| ef:activity/change/20260822T0600486828500000/388591 | properties | ef:agent/normalise_property_values | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v17 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v18 |
| ef:activity/change/20260822T0600486828500000/395395 | types | ef:agent/link_flows_to_their_substance | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v18 | ef:flow/3191873c-df0b-44ce-a75e-cfd0596c8bec/v19 |