Tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol
Everything that changed this flow. Back to the flow
75d41ffd-bcaf-431e-8263-18ab8e20e483
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 4 candidate structures, so no one mass describes it |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol||dimension=Environmental > media=Air > indoor=Unknown; cas=26896-48-0; added Common Chemistry CAS names as altLabel: Tricyclodecanedimethanol; object_uuid=fo-82463fdcdade6272 |
| cas_match_labels | 1 | consensus_match | group_key=tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'26896-48-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-82463fdcdade6272: {'26896-48-0': '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=['26896-48-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[6448, 98091, 160138, 10921470, 22347887]; selected_pubchem_cids=[160138, 10921470, 22347887]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 6,506 | bootstrap_labels | prefLabel | — | [{"@value":"tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | Bootstrapped prefLabel from legacy name field |
| 6,507 | bootstrap_labels | name | tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol | — | Purged legacy name field to enforce prefLabel usage |
| 6,508 | bootstrap_labels | synonyms | ["organic","tricyclodecanedimethanol","octahydro-4,7-methano-1h-indenedimethanol","tcdalcoholdm"] | [] | Removed legacy synonyms field in favor of structured labels |
| 119,920 | 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 |
| 119,921 | 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 |
| 215,511 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,586 | normalize_name_case | prefLabel | [{"@value":"tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | [{"@value":"Tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,427 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=3) |
| 233,428 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,429 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.659.028I","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['26896-48-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[6448, 98091, 160138, 10921470, 22347887]; selected_pubchem_cids=[160138, 10921470, 22347887]; 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 |
| 250,116 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | rdkit_pre_consensus from 'C1C(CC2C1C3CC(C2C3)CO)CO'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 272,871 | consensus_match | altLabel | [] | [{"@value":"Tricyclodecanedimethanol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | group_key=tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol||dimension=Environmental > media=Air > indoor=Unknown; cas=26896-48-0; added Common Chemistry CAS names as altLabel: Tricyclodecanedimethanol; object_uuid=fo-82463fdcdade6272 |
| 272,872 | consensus_match | cas_match_labels | — | {"26896-48-0":"exactMatch"} | group_key=tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'26896-48-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-82463fdcdade6272: {'26896-48-0': 'exactMatch'} |
| 275,253 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tricyclo[2.2.2.2~1,4~]decane-2,5-diyldimethanol' |
| 281,759 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | rdkit_post_consensus from 'OCC1CC23CCC1(CC2)CC3CO'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,861 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O2"]… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 4 candidate structures, so no one mass describes it |
| 340,958 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/75d41ffd-bcaf-… | associations resolved on the elementary layer |
| 396,759 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260821T1554374006150000/6506 | prefLabel | ef:agent/bootstrap_labels | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v0 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v1 |
| ef:activity/change/20260821T1554374006150000/6507 | name | ef:agent/bootstrap_labels | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v1 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v2 |
| ef:activity/change/20260821T1554374006150000/6508 | synonyms | ef:agent/bootstrap_labels | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v2 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v3 |
| ef:activity/change/20260821T1554374006150000/119920 | context | ef:agent/default_context_mapping | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v3 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v4 |
| ef:activity/change/20260821T1554374006150000/119921 | context_iri | ef:agent/default_context_mapping | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v4 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v5 |
| ef:activity/change/20260821T1554374006150000/215511 | unit_iri | ef:agent/unit_normalization | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v5 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v6 |
| ef:activity/change/20260821T1554374006150000/222586 | prefLabel | ef:agent/normalize_name_case | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v6 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v7 |
| ef:activity/change/20260821T1554374006150000/233427 | properties | ef:agent/enrich_references | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v7 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v8 |
| ef:activity/change/20260821T1554374006150000/233428 | skos_definition | ef:agent/enrich_references | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v8 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v9 |
| ef:activity/change/20260821T1554374006150000/233429 | references | ef:agent/enrich_references | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v9 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v10 |
| ef:activity/change/20260821T1554374006150000/250116 | properties | ef:agent/rdkit_pre_consensus | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v10 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v11 |
| ef:activity/change/20260821T1554374006150000/272871 | altLabel | ef:agent/consensus_match | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v11 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v12 |
| ef:activity/change/20260821T1554374006150000/272872 | cas_match_labels | ef:agent/consensus_match | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v12 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v13 |
| ef:activity/change/20260821T1554374006150000/275253 | properties | ef:agent/opsin_iupac | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v13 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v14 |
| ef:activity/change/20260821T1554374006150000/281759 | properties | ef:agent/rdkit_post_consensus | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v14 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v15 |
| ef:activity/change/20260821T1554374006150000/286861 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v15 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v16 |
| ef:activity/change/20260821T1554374006150000/340958 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v16 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v17 |
| ef:activity/change/20260821T1554374006150000/396759 | types | ef:agent/link_flows_to_their_substance | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v17 | ef:flow/75d41ffd-bcaf-431e-8263-18ab8e20e483/v18 |