Triglyme
Everything that changed this flow. Back to the flow
cfa0d644-94ac-41e8-b976-96607d746468
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 2 catalogue altLabel value(s): 'Ansul Ether 161' (trade name), 'NSC 66400' (registry code) |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=112-49-2; cc_chebi_agreed_name='Triglyme'; object_uuid=fo-7e8c231c1a42a754 |
| cas_match_labels | 1 | consensus_match | group_key=2,5,8,11-tetraoxadodecane||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'112-49-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7e8c231c1a42a754: {'112-49-2': '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=['112-49-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_44842']; candidate_pubchem_cids=[8189, 79140, 82406]; selected_pubchem_cids=[8189]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 10,176 | bootstrap_labels | prefLabel | — | [{"@value":"2,5,8,11-tetraoxadodecane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Bootstrapped prefLabel from legacy name field |
| 10,177 | bootstrap_labels | name | 2,5,8,11-tetraoxadodecane | — | Purged legacy name field to enforce prefLabel usage |
| 10,178 | bootstrap_labels | synonyms | ["organic","1,2-bis(2-methoxyethoxy)ethane","1,2-bis(2-methoxyethoxy)ethane(tegdme,triglyme)","tegdme","triethyleneglyc… | [] | Removed legacy synonyms field in favor of structured labels |
| 172,738 | 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) |
| 172,739 | 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) |
| 216,718 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,891 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 236,892 | enrich_references | skos_definition | — | [{"@value":"A polyether that consists of dodecane in which the carbon atoms at positions 2, 5, 8 and 11 are replaced by… | Merged ChEBI/PubChem definitions into skos:definition |
| 236,893 | enrich_references | references | [] | [{"@id":"gmelin:675792","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"con… | Added references with provenance; cas_numbers=['112-49-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_44842']; candidate_pubchem_cids=[8189, 79140, 82406]; selected_pubchem_cids=[8189]; 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 |
| 251,108 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | rdkit_pre_consensus from 'COCCOCCOCCOC'; added: monoisotopic_mass |
| 255,825 | chebi_altlabels | altLabel | [] | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 260,006 | consensus_match | prefLabel | [{"@value":"2,5,8,11-tetraoxadodecane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | [{"@value":"Triglyme","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consen… | cas=112-49-2; cc_chebi_agreed_name='Triglyme'; object_uuid=fo-7e8c231c1a42a754 |
| 260,007 | consensus_match | altLabel | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | cas=112-49-2; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-7e8c231c1a42a754 |
| 260,008 | consensus_match | altLabel | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | group_key=2,5,8,11-tetraoxadodecane||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=112-49-2; added Common Chemistry CAS names as altLabel: Ansul Ether 161, DMTG, Ethane, 1,2-bis(2-methoxyethoxy)-, Hisolve MTM, Hisorb MTM, Methyltriglyme, NSC 66400, Triethylene glycol dimethyl ether; object_uuid=fo-7e8c231c1a42a754 |
| 260,009 | consensus_match | cas_match_labels | — | {"112-49-2":"exactMatch"} | group_key=2,5,8,11-tetraoxadodecane||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'112-49-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7e8c231c1a42a754: {'112-49-2': 'exactMatch'} |
| 276,294 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Triglyme' |
| 282,884 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | rdkit_post_consensus from 'COCCOCCOCCOC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,374 | strip_catalogue_altlabels | altLabel | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"1,2-bis(2-methoxyethoxy)ethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | Removed 2 catalogue altLabel value(s): 'Ansul Ether 161' (trade name), 'NSC 66400' (registry code) |
| 367,393 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/cfa0d644-94ac-… | associations resolved on the elementary layer |
| 390,638 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O4"],… | typed the way the ontology types it |
| 398,335 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260821T1554374006150000/10176 | prefLabel | ef:agent/bootstrap_labels | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v0 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v1 |
| ef:activity/change/20260821T1554374006150000/10177 | name | ef:agent/bootstrap_labels | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v1 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v2 |
| ef:activity/change/20260821T1554374006150000/10178 | synonyms | ef:agent/bootstrap_labels | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v2 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v3 |
| ef:activity/change/20260821T1554374006150000/172738 | context | ef:agent/default_context_mapping | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v3 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v4 |
| ef:activity/change/20260821T1554374006150000/172739 | context_iri | ef:agent/default_context_mapping | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v4 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v5 |
| ef:activity/change/20260821T1554374006150000/216718 | unit_iri | ef:agent/unit_normalization | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v5 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v6 |
| ef:activity/change/20260821T1554374006150000/236891 | properties | ef:agent/enrich_references | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v6 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v7 |
| ef:activity/change/20260821T1554374006150000/236892 | skos_definition | ef:agent/enrich_references | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v7 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v8 |
| ef:activity/change/20260821T1554374006150000/236893 | references | ef:agent/enrich_references | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v8 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v9 |
| ef:activity/change/20260821T1554374006150000/251108 | properties | ef:agent/rdkit_pre_consensus | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v9 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v10 |
| ef:activity/change/20260821T1554374006150000/255825 | altLabel | ef:agent/chebi_altlabels | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v10 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v11 |
| ef:activity/change/20260821T1554374006150000/260006 | prefLabel | ef:agent/consensus_match | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v11 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v12 |
| ef:activity/change/20260821T1554374006150000/260007 | altLabel | ef:agent/consensus_match | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v12 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v13 |
| ef:activity/change/20260821T1554374006150000/260008 | altLabel | ef:agent/consensus_match | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v13 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v14 |
| ef:activity/change/20260821T1554374006150000/260009 | cas_match_labels | ef:agent/consensus_match | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v14 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v15 |
| ef:activity/change/20260821T1554374006150000/276294 | properties | ef:agent/opsin_iupac | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v15 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v16 |
| ef:activity/change/20260821T1554374006150000/282884 | properties | ef:agent/rdkit_post_consensus | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v16 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v17 |
| ef:activity/change/20260821T1554374006150000/289374 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v17 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v18 |
| ef:activity/change/20260821T1554374006150000/367393 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v18 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v19 |
| ef:activity/change/20260821T1554374006150000/390638 | properties | ef:agent/normalise_property_values | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v19 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v20 |
| ef:activity/change/20260821T1554374006150000/398335 | types | ef:agent/link_flows_to_their_substance | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v20 | ef:flow/cfa0d644-94ac-41e8-b976-96607d746468/v21 |