Tributyl Citrate
Everything that changed this flow. Back to the flow
dce70eed-0a34-4c1c-b28a-7d2e4122a339
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 4 catalogue altLabel value(s): 'BN 63' (grade code), 'LM 30' (grade code), 'LM 30 (ester)' (grade code), 'NSC 8491' (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=tributylcitrate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'77-94-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-067f199991d288e4: {'77-94-1': '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=['77-94-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_176825']; candidate_pubchem_cids=[6507, 282132]; selected_pubchem_cids=[6507]; 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 |
|---|---|---|---|---|---|
| 12,909 | bootstrap_labels | prefLabel | — | [{"@value":"tributyl citrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 12,910 | bootstrap_labels | name | tributyl citrate | — | Purged legacy name field to enforce prefLabel usage |
| 12,911 | bootstrap_labels | synonyms | ["organic","tributylcitrate","uniplex83"] | [] | Removed legacy synonyms field in favor of structured labels |
| 181,460 | 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 |
| 181,461 | 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 |
| 217,609 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,081 | normalize_name_case | prefLabel | [{"@value":"tributyl citrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Tributyl Citrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,431 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 239,432 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,433 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.216A","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['77-94-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_176825']; candidate_pubchem_cids=[6507, 282132]; selected_pubchem_cids=[6507]; 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 |
| 251,839 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | rdkit_pre_consensus from 'CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)O'; added: monoisotopic_mass |
| 256,148 | chebi_altlabels | altLabel | [] | [{"@value":"tributyl 2-hydroxypropane-1,2,3-tricarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_alt… | Added 1 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 272,779 | consensus_match | altLabel | [{"@value":"tributyl 2-hydroxypropane-1,2,3-tricarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_alt… | [{"@value":"tributyl 2-hydroxypropane-1,2,3-tricarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_alt… | group_key=tributylcitrate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=77-94-1; added Common Chemistry CAS names as altLabel: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,2,3-tributyl ester, 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, tributyl ester, 2-Hydroxy-1,2,3-propanetricarboxylic acid tributyl ester, BN 63, Butyl citrate, Citra PL 40, Citric acid, tributyl ester, Citroflex 4, Citroflex C 4, Citrofol B 1, Citrofol BI, LM 30, LM 30 (ester), Morflex TBC, NSC 8491, Scandinol SP 21, TBC, Tri-<em>n</em>-butyl citrate, Uniplex 83; object_uuid=fo-067f199991d288e4 |
| 272,780 | consensus_match | cas_match_labels | — | {"77-94-1":"exactMatch"} | group_key=tributylcitrate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'77-94-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-067f199991d288e4: {'77-94-1': 'exactMatch'} |
| 277,031 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tributyl Citrate' |
| 283,683 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | rdkit_post_consensus from 'CCCCOC(=O)CC(O)(CC(=O)OCCCC)C(=O)OCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,909 | strip_catalogue_altlabels | altLabel | [{"@value":"tributyl 2-hydroxypropane-1,2,3-tricarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_alt… | [{"@value":"tributyl 2-hydroxypropane-1,2,3-tricarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_alt… | Removed 4 catalogue altLabel value(s): 'BN 63' (grade code), 'LM 30' (grade code), 'LM 30 (ester)' (grade code), 'NSC 8491' (registry code) |
| 371,756 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/dce70eed-0a34-… | associations resolved on the elementary layer |
| 391,383 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O7"]… | typed the way the ontology types it |
| 399,391 | 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/20260821T1302361922970000/12909 | prefLabel | ef:agent/bootstrap_labels | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v0 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v1 |
| ef:activity/change/20260821T1302361922970000/12910 | name | ef:agent/bootstrap_labels | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v1 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v2 |
| ef:activity/change/20260821T1302361922970000/12911 | synonyms | ef:agent/bootstrap_labels | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v2 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v3 |
| ef:activity/change/20260821T1302361922970000/181460 | context | ef:agent/default_context_mapping | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v3 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v4 |
| ef:activity/change/20260821T1302361922970000/181461 | context_iri | ef:agent/default_context_mapping | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v4 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v5 |
| ef:activity/change/20260821T1302361922970000/217609 | unit_iri | ef:agent/unit_normalization | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v5 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v6 |
| ef:activity/change/20260821T1302361922970000/224081 | prefLabel | ef:agent/normalize_name_case | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v6 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v7 |
| ef:activity/change/20260821T1302361922970000/239431 | properties | ef:agent/enrich_references | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v7 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v8 |
| ef:activity/change/20260821T1302361922970000/239432 | skos_definition | ef:agent/enrich_references | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v8 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v9 |
| ef:activity/change/20260821T1302361922970000/239433 | references | ef:agent/enrich_references | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v9 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v10 |
| ef:activity/change/20260821T1302361922970000/251839 | properties | ef:agent/rdkit_pre_consensus | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v10 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v11 |
| ef:activity/change/20260821T1302361922970000/256148 | altLabel | ef:agent/chebi_altlabels | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v11 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v12 |
| ef:activity/change/20260821T1302361922970000/272779 | altLabel | ef:agent/consensus_match | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v12 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v13 |
| ef:activity/change/20260821T1302361922970000/272780 | cas_match_labels | ef:agent/consensus_match | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v13 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v14 |
| ef:activity/change/20260821T1302361922970000/277031 | properties | ef:agent/opsin_iupac | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v14 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v15 |
| ef:activity/change/20260821T1302361922970000/283683 | properties | ef:agent/rdkit_post_consensus | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v15 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v16 |
| ef:activity/change/20260821T1302361922970000/289909 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v16 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v17 |
| ef:activity/change/20260821T1302361922970000/371756 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v17 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v18 |
| ef:activity/change/20260821T1302361922970000/391383 | properties | ef:agent/normalise_property_values | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v18 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v19 |
| ef:activity/change/20260821T1302361922970000/399391 | types | ef:agent/link_flows_to_their_substance | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v19 | ef:flow/dce70eed-0a34-4c1c-b28a-7d2e4122a339/v20 |