Dimethyl Sebacate
Everything that changed this flow. Back to the flow
16ed94eb-e826-48b7-b4dd-6f9db130ec18
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 9415' (registry code) |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=dimethylsebacate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'106-79-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3c4b847018bd9ac8: {'106-79-6': '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 air, unspecified |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['106-79-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_194205']; candidate_pubchem_cids=[7829, 12902, 386817]; selected_pubchem_cids=[7829]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 10,500 | bootstrap_labels | prefLabel | — | [{"@value":"dimethyl sebacate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Bootstrapped prefLabel from legacy name field |
| 10,501 | bootstrap_labels | name | dimethyl sebacate | — | Purged legacy name field to enforce prefLabel usage |
| 10,502 | bootstrap_labels | synonyms | ["organic","dimethylsebacate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 50,839 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 50,840 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 216,826 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,556 | normalize_name_case | prefLabel | [{"@value":"dimethyl sebacate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | [{"@value":"Dimethyl Sebacate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 237,185 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 237,186 | enrich_references | skos_definition | — | [{"@value":"A fatty acid methyl ester that is sebacic acid in which both carboxy groups are replaced by methoxycarbonyl… | Merged ChEBI/PubChem definitions into skos:definition |
| 237,187 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.246H","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['106-79-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_194205']; candidate_pubchem_cids=[7829, 12902, 386817]; selected_pubchem_cids=[7829]; 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 |
| 251,190 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | rdkit_pre_consensus from 'COC(=O)CCCCCCCCC(=O)OC'; added: monoisotopic_mass |
| 255,878 | chebi_altlabels | altLabel | [] | [{"@value":"1,10-decanedioic acid dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","p… | Added 11 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 266,124 | consensus_match | altLabel | [{"@value":"1,10-decanedioic acid dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","p… | [{"@value":"1,10-decanedioic acid dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","p… | group_key=dimethylsebacate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=106-79-6; added Common Chemistry CAS names as altLabel: Dimethyldecanedioate, NSC 9415; object_uuid=fo-3c4b847018bd9ac8 |
| 266,125 | consensus_match | cas_match_labels | — | {"106-79-6":"exactMatch"} | group_key=dimethylsebacate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'106-79-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3c4b847018bd9ac8: {'106-79-6': 'exactMatch'} |
| 276,376 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Dimethyl Sebacate' |
| 282,976 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | rdkit_post_consensus from 'COC(=O)CCCCCCCCC(=O)OC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,459 | strip_catalogue_altlabels | altLabel | [{"@value":"1,10-decanedioic acid dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","p… | [{"@value":"1,10-decanedioic acid dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","p… | Removed 1 catalogue altLabel value(s): 'NSC 9415' (registry code) |
| 306,487 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/16ed94eb-e826-… | associations resolved on the elementary layer |
| 390,753 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | typed the way the ontology types it |
| 398,499 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20261019T0712047113160000/10500 | prefLabel | ef:agent/bootstrap_labels | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v0 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v1 |
| ef:activity/change/20261019T0712047113160000/10501 | name | ef:agent/bootstrap_labels | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v1 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v2 |
| ef:activity/change/20261019T0712047113160000/10502 | synonyms | ef:agent/bootstrap_labels | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v2 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v3 |
| ef:activity/change/20261019T0712047113160000/50839 | context | ef:agent/default_context_mapping | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v3 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v4 |
| ef:activity/change/20261019T0712047113160000/50840 | context_iri | ef:agent/default_context_mapping | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v4 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v5 |
| ef:activity/change/20261019T0712047113160000/216826 | unit_iri | ef:agent/unit_normalization | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v5 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v6 |
| ef:activity/change/20261019T0712047113160000/223556 | prefLabel | ef:agent/normalize_name_case | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v6 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v7 |
| ef:activity/change/20261019T0712047113160000/237185 | properties | ef:agent/enrich_references | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v7 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v8 |
| ef:activity/change/20261019T0712047113160000/237186 | skos_definition | ef:agent/enrich_references | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v8 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v9 |
| ef:activity/change/20261019T0712047113160000/237187 | references | ef:agent/enrich_references | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v9 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v10 |
| ef:activity/change/20261019T0712047113160000/251190 | properties | ef:agent/rdkit_pre_consensus | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v10 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v11 |
| ef:activity/change/20261019T0712047113160000/255878 | altLabel | ef:agent/chebi_altlabels | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v11 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v12 |
| ef:activity/change/20261019T0712047113160000/266124 | altLabel | ef:agent/consensus_match | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v12 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v13 |
| ef:activity/change/20261019T0712047113160000/266125 | cas_match_labels | ef:agent/consensus_match | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v13 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v14 |
| ef:activity/change/20261019T0712047113160000/276376 | properties | ef:agent/opsin_iupac | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v14 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v15 |
| ef:activity/change/20261019T0712047113160000/282976 | properties | ef:agent/rdkit_post_consensus | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v15 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v16 |
| ef:activity/change/20261019T0712047113160000/289459 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v16 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v17 |
| ef:activity/change/20261019T0712047113160000/306487 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v17 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v18 |
| ef:activity/change/20261019T0712047113160000/390753 | properties | ef:agent/normalise_property_values | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v18 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v19 |
| ef:activity/change/20261019T0712047113160000/398499 | types | ef:agent/link_flows_to_their_substance | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v19 | ef:flow/16ed94eb-e826-48b7-b4dd-6f9db130ec18/v20 |