Pinane
Everything that changed this flow. Back to the flow
453dd055-2793-4d4d-9666-5a454ceaaabd
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 76674' (registry code) |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=473-55-2; cc_chebi_agreed_name='Pinane'; object_uuid=fo-3d23da947b4557e6 |
| cas_match_labels | 1 | consensus_match | group_key=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory']; cas_sources={'473-55-2': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3d23da947b4557e6: {'473-55-2': '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 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=['473-55-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_35710']; candidate_pubchem_cids=[10129, 17755566, 54480145]; selected_pubchem_cids=[10129]; 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 |
|---|---|---|---|---|---|
| 9,693 | bootstrap_labels | prefLabel | — | [{"@value":"2,6,6-trimethylbicyclo[3.1.1]heptane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | Bootstrapped prefLabel from legacy name field |
| 9,694 | bootstrap_labels | name | 2,6,6-trimethylbicyclo[3.1.1]heptane | — | Purged legacy name field to enforce prefLabel usage |
| 9,695 | bootstrap_labels | synonyms | ["(-)-trans-Pinane","(1R-(1alpha,2alpha,5alpha))-2,6,6-Trimethylbicyclo(3.1.1)heptane","(1R-(1alpha,2beta,5alpha))-2,6,… | [] | Removed legacy synonyms field in favor of structured labels |
| 82,498 | 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 |
| 82,499 | 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 |
| 216,560 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,442 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 236,443 | enrich_references | skos_definition | — | [{"@value":"A monoterpene that is bicyclo[3.1.1]heptane substituted by methyl groups at positions 2, 6 and 6.","@langua… | Merged ChEBI/PubChem definitions into skos:definition |
| 236,444 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.284C","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['473-55-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_35710']; candidate_pubchem_cids=[10129, 17755566, 54480145]; selected_pubchem_cids=[10129]; 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 |
| 250,979 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | rdkit_pre_consensus from 'CC1CCC2CC1C2(C)C'; added: monoisotopic_mass |
| 255,769 | chebi_altlabels | altLabel | [] | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 260,067 | consensus_match | prefLabel | [{"@value":"2,6,6-trimethylbicyclo[3.1.1]heptane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | [{"@value":"Pinane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensu… | cas=473-55-2; cc_chebi_agreed_name='Pinane'; object_uuid=fo-3d23da947b4557e6 |
| 260,068 | consensus_match | altLabel | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | cas=473-55-2; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-3d23da947b4557e6 |
| 260,069 | consensus_match | altLabel | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | group_key=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; cas=473-55-2; added Common Chemistry CAS names as altLabel: Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, NSC 76674; object_uuid=fo-3d23da947b4557e6 |
| 260,070 | consensus_match | cas_match_labels | — | {"473-55-2":"exactMatch"} | group_key=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory']; cas_sources={'473-55-2': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3d23da947b4557e6: {'473-55-2': 'exactMatch'} |
| 276,166 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Pinane' |
| 282,746 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | rdkit_post_consensus from 'CC1CCC2CC1C2(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,285 | strip_catalogue_altlabels | altLabel | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | [{"@value":"dihydropinene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | Removed 1 catalogue altLabel value(s): 'NSC 76674' (registry code) |
| 322,263 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/453dd055-2793-… | associations resolved on the elementary layer |
| 390,510 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18"],"… | typed the way the ontology types it |
| 398,148 | 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/20260821T1554374006150000/9693 | prefLabel | ef:agent/bootstrap_labels | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v0 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v1 |
| ef:activity/change/20260821T1554374006150000/9694 | name | ef:agent/bootstrap_labels | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v1 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v2 |
| ef:activity/change/20260821T1554374006150000/9695 | synonyms | ef:agent/bootstrap_labels | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v2 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v3 |
| ef:activity/change/20260821T1554374006150000/82498 | context | ef:agent/default_context_mapping | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v3 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v4 |
| ef:activity/change/20260821T1554374006150000/82499 | context_iri | ef:agent/default_context_mapping | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v4 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v5 |
| ef:activity/change/20260821T1554374006150000/216560 | unit_iri | ef:agent/unit_normalization | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v5 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v6 |
| ef:activity/change/20260821T1554374006150000/236442 | properties | ef:agent/enrich_references | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v6 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v7 |
| ef:activity/change/20260821T1554374006150000/236443 | skos_definition | ef:agent/enrich_references | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v7 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v8 |
| ef:activity/change/20260821T1554374006150000/236444 | references | ef:agent/enrich_references | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v8 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v9 |
| ef:activity/change/20260821T1554374006150000/250979 | properties | ef:agent/rdkit_pre_consensus | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v9 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v10 |
| ef:activity/change/20260821T1554374006150000/255769 | altLabel | ef:agent/chebi_altlabels | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v10 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v11 |
| ef:activity/change/20260821T1554374006150000/260067 | prefLabel | ef:agent/consensus_match | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v11 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v12 |
| ef:activity/change/20260821T1554374006150000/260068 | altLabel | ef:agent/consensus_match | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v12 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v13 |
| ef:activity/change/20260821T1554374006150000/260069 | altLabel | ef:agent/consensus_match | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v13 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v14 |
| ef:activity/change/20260821T1554374006150000/260070 | cas_match_labels | ef:agent/consensus_match | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v14 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v15 |
| ef:activity/change/20260821T1554374006150000/276166 | properties | ef:agent/opsin_iupac | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v15 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v16 |
| ef:activity/change/20260821T1554374006150000/282746 | properties | ef:agent/rdkit_post_consensus | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v16 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v17 |
| ef:activity/change/20260821T1554374006150000/289285 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v17 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v18 |
| ef:activity/change/20260821T1554374006150000/322263 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v18 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v19 |
| ef:activity/change/20260821T1554374006150000/390510 | properties | ef:agent/normalise_property_values | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v19 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v20 |
| ef:activity/change/20260821T1554374006150000/398148 | types | ef:agent/link_flows_to_their_substance | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v20 | ef:flow/453dd055-2793-4d4d-9666-5a454ceaaabd/v21 |