1,4-dithiane
Everything that changed this flow. Back to the flow
21363fdb-5767-45c2-889d-4a3dc7c83fdb
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 24178' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1,4-dithiane||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'505-29-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a99c7c22f0b5f98c: {'505-29-3': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['505-29-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_540']; candidate_pubchem_cids=[10452]; selected_pubchem_cids=[10452]; 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 |
|---|---|---|---|---|---|
| 8,708 | bootstrap_labels | prefLabel | — | [{"@value":"1,4-dithiane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | Bootstrapped prefLabel from legacy name field |
| 8,709 | bootstrap_labels | name | 1,4-dithiane | — | Purged legacy name field to enforce prefLabel usage |
| 18,297 | bootstrap_labels | synonyms | ["1,4-dithiane","1,4-Dithiacyclohexane","1,4-Dithiin, tetrahydro-","1,4-dithian","AC1L1V88","AC1Q1ICP","Diethylene disu… | [] | Removed legacy synonyms field in favor of structured labels |
| 58,880 | 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 |
| 58,881 | 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 |
| 216,237 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 235,507 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 235,508 | enrich_references | skos_definition | — | [{"@value":"A dithiane that is cyclohexane in which the -CH2- units at positions 1 and 2 have been replaced by sulfur a… | Merged ChEBI/PubChem definitions into skos:definition |
| 235,509 | enrich_references | references | [] | [{"@id":"gmelin:2182","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"conse… | Added references with provenance; cas_numbers=['505-29-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_540']; candidate_pubchem_cids=[10452]; selected_pubchem_cids=[10452]; 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 |
| 250,712 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | rdkit_pre_consensus from 'C1CSCCS1'; added: monoisotopic_mass |
| 255,612 | chebi_altlabels | altLabel | [] | [{"@value":"1,4-Dithian","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 258,710 | consensus_match | altLabel | [{"@value":"1,4-Dithian","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | [{"@value":"1,4-Dithian","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | group_key=1,4-dithiane||dimension=Environmental > media=Water > water_body=Long-term; cas=505-29-3; added Common Chemistry CAS names as altLabel: 1,4-Dithiin, tetrahydro-, NSC 24178; object_uuid=fo-a99c7c22f0b5f98c |
| 258,711 | consensus_match | cas_match_labels | — | {"505-29-3":"exactMatch"} | group_key=1,4-dithiane||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'505-29-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a99c7c22f0b5f98c: {'505-29-3': 'exactMatch'} |
| 275,875 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,4-dithiane' |
| 282,440 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | rdkit_post_consensus from 'C1CSCCS1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,055 | strip_catalogue_altlabels | altLabel | [{"@value":"1,4-Dithian","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | [{"@value":"1,4-Dithian","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"con… | Removed 1 catalogue altLabel value(s): 'NSC 24178' (registry code) |
| 310,455 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/21363fdb-5767-… | associations resolved on the elementary layer |
| 390,218 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H8S2"],"… | typed the way the ontology types it |
| 397,740 | 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/20260820T1812399309960000/8708 | prefLabel | ef:agent/bootstrap_labels | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v0 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v1 |
| ef:activity/change/20260820T1812399309960000/8709 | name | ef:agent/bootstrap_labels | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v1 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v2 |
| ef:activity/change/20260820T1812399309960000/18297 | synonyms | ef:agent/bootstrap_labels | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v2 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v3 |
| ef:activity/change/20260820T1812399309960000/58880 | context | ef:agent/default_context_mapping | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v3 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v4 |
| ef:activity/change/20260820T1812399309960000/58881 | context_iri | ef:agent/default_context_mapping | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v4 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v5 |
| ef:activity/change/20260820T1812399309960000/216237 | unit_iri | ef:agent/unit_normalization | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v5 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v6 |
| ef:activity/change/20260820T1812399309960000/235507 | properties | ef:agent/enrich_references | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v6 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v7 |
| ef:activity/change/20260820T1812399309960000/235508 | skos_definition | ef:agent/enrich_references | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v7 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v8 |
| ef:activity/change/20260820T1812399309960000/235509 | references | ef:agent/enrich_references | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v8 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v9 |
| ef:activity/change/20260820T1812399309960000/250712 | properties | ef:agent/rdkit_pre_consensus | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v9 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v10 |
| ef:activity/change/20260820T1812399309960000/255612 | altLabel | ef:agent/chebi_altlabels | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v10 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v11 |
| ef:activity/change/20260820T1812399309960000/258710 | altLabel | ef:agent/consensus_match | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v11 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v12 |
| ef:activity/change/20260820T1812399309960000/258711 | cas_match_labels | ef:agent/consensus_match | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v12 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v13 |
| ef:activity/change/20260820T1812399309960000/275875 | properties | ef:agent/opsin_iupac | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v13 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v14 |
| ef:activity/change/20260820T1812399309960000/282440 | properties | ef:agent/rdkit_post_consensus | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v14 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v15 |
| ef:activity/change/20260820T1812399309960000/289055 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v15 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v16 |
| ef:activity/change/20260820T1812399309960000/310455 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v16 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v17 |
| ef:activity/change/20260820T1812399309960000/390218 | properties | ef:agent/normalise_property_values | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v17 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v18 |
| ef:activity/change/20260820T1812399309960000/397740 | types | ef:agent/link_flows_to_their_substance | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v18 | ef:flow/21363fdb-5767-45c2-889d-4a3dc7c83fdb/v19 |