Dipropyl disulfide
Everything that changed this flow. Back to the flow
c3aa3188-a269-491b-ba1c-45355eb1e380
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 75122' (registry code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=629-19-6; cc_chebi_agreed_name='Dipropyl disulfide'; object_uuid=fo-719fd82b4bdb3012 |
| cas_match_labels | 1 | consensus_match | group_key=dipropyldisulphide||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'629-19-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-719fd82b4bdb3012: {'629-19-6': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['629-19-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_45758']; candidate_pubchem_cids=[12377]; selected_pubchem_cids=[12377]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,196 | bootstrap_labels | prefLabel | — | [{"@value":"dipropyl disulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 9,197 | bootstrap_labels | name | dipropyl disulphide | — | Purged legacy name field to enforce prefLabel usage |
| 9,198 | bootstrap_labels | synonyms | ["1,1'-dithiodipropane","1-(Propyldisulfanyl)propane","4,5-DITHIAOCTANE","AC1L1ZGR","Di-n-propyl disulfide","Dipropyl d… | [] | Removed legacy synonyms field in favor of structured labels |
| 165,678 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 165,679 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 216,399 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,264 | normalize_name_case | prefLabel | [{"@value":"dipropyl disulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | [{"@value":"Dipropyl Disulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 235,980 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 235,981 | enrich_references | skos_definition | — | [{"@value":"An organic disulfide where the alkyl groups specified are propyl. It is a component of the essential oils o… | Merged ChEBI/PubChem definitions into skos:definition |
| 235,982 | enrich_references | references | [] | [{"@id":"beilstein:969200","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['629-19-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_45758']; candidate_pubchem_cids=[12377]; selected_pubchem_cids=[12377]; 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 |
| 250,845 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | rdkit_pre_consensus from 'CCCSSCCC'; added: monoisotopic_mass |
| 255,713 | chebi_altlabels | altLabel | [] | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | Added 7 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 266,300 | consensus_match | prefLabel | [{"@value":"Dipropyl Disulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | [{"@value":"Dipropyl disulfide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedT… | cas=629-19-6; cc_chebi_agreed_name='Dipropyl disulfide'; object_uuid=fo-719fd82b4bdb3012 |
| 266,301 | consensus_match | altLabel | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | cas=629-19-6; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-719fd82b4bdb3012 |
| 266,302 | consensus_match | altLabel | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | group_key=dipropyldisulphide||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=629-19-6; added Common Chemistry CAS names as altLabel: Disulfide, dipropyl, NSC 75122; object_uuid=fo-719fd82b4bdb3012 |
| 266,303 | consensus_match | cas_match_labels | — | {"629-19-6":"exactMatch"} | group_key=dipropyldisulphide||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'629-19-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-719fd82b4bdb3012: {'629-19-6': 'exactMatch'} |
| 276,032 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Dipropyl disulfide' |
| 282,602 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | rdkit_post_consensus from 'CCCSSCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,185 | strip_catalogue_altlabels | altLabel | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"1,1'-dithiodipropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | Removed 1 catalogue altLabel value(s): 'NSC 75122' (registry code) |
| 363,865 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c3aa3188-a269-… | associations resolved on the elementary layer |
| 390,379 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14S2"],… | typed the way the ontology types it |
| 397,961 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260822T0600486828500000/9196 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v0 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v1 |
| ef:activity/change/20260822T0600486828500000/9197 | name | ef:agent/bootstrap_labels | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v1 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v2 |
| ef:activity/change/20260822T0600486828500000/9198 | synonyms | ef:agent/bootstrap_labels | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v2 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v3 |
| ef:activity/change/20260822T0600486828500000/165678 | context | ef:agent/default_context_mapping | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v3 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v4 |
| ef:activity/change/20260822T0600486828500000/165679 | context_iri | ef:agent/default_context_mapping | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v4 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v5 |
| ef:activity/change/20260822T0600486828500000/216399 | unit_iri | ef:agent/unit_normalization | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v5 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v6 |
| ef:activity/change/20260822T0600486828500000/223264 | prefLabel | ef:agent/normalize_name_case | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v6 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v7 |
| ef:activity/change/20260822T0600486828500000/235980 | properties | ef:agent/enrich_references | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v7 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v8 |
| ef:activity/change/20260822T0600486828500000/235981 | skos_definition | ef:agent/enrich_references | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v8 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v9 |
| ef:activity/change/20260822T0600486828500000/235982 | references | ef:agent/enrich_references | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v9 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v10 |
| ef:activity/change/20260822T0600486828500000/250845 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v10 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v11 |
| ef:activity/change/20260822T0600486828500000/255713 | altLabel | ef:agent/chebi_altlabels | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v11 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v12 |
| ef:activity/change/20260822T0600486828500000/266300 | prefLabel | ef:agent/consensus_match | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v12 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v13 |
| ef:activity/change/20260822T0600486828500000/266301 | altLabel | ef:agent/consensus_match | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v13 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v14 |
| ef:activity/change/20260822T0600486828500000/266302 | altLabel | ef:agent/consensus_match | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v14 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v15 |
| ef:activity/change/20260822T0600486828500000/266303 | cas_match_labels | ef:agent/consensus_match | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v15 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v16 |
| ef:activity/change/20260822T0600486828500000/276032 | properties | ef:agent/opsin_iupac | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v16 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v17 |
| ef:activity/change/20260822T0600486828500000/282602 | properties | ef:agent/rdkit_post_consensus | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v17 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v18 |
| ef:activity/change/20260822T0600486828500000/289185 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v18 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v19 |
| ef:activity/change/20260822T0600486828500000/363865 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v19 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v20 |
| ef:activity/change/20260822T0600486828500000/390379 | properties | ef:agent/normalise_property_values | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v20 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v21 |
| ef:activity/change/20260822T0600486828500000/397961 | types | ef:agent/link_flows_to_their_substance | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v21 | ef:flow/c3aa3188-a269-491b-ba1c-45355eb1e380/v22 |