1,2,3-trihexyl 2-(butanoyloxy)propane-1,2,3-tricarboxylate
Everything that changed this flow. Back to the flow
17a20e1b-95b2-42b7-8b79-d22e55c6715f
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 | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=1,2,3-trihexyl2-(butanoyloxy)propane-1,2,3-tricarboxylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'82469-79-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-98dbb1374de8c6a2: {'82469-79-2': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['82469-79-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[133914, 563248, 21863462, 22446079, 145712238]; selected_pubchem_cids=[133914]; 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 |
|---|---|---|---|---|---|
| 15,676 | bootstrap_labels | prefLabel | — | [{"@value":"1,2,3-trihexyl 2-(butanoyloxy)propane-1,2,3-tricarboxylate","@language":"en","source":{"prov:wasGeneratedBy… | Bootstrapped prefLabel from legacy name field |
| 15,677 | bootstrap_labels | name | 1,2,3-trihexyl 2-(butanoyloxy)propane-1,2,3-tricarboxylate | — | Purged legacy name field to enforce prefLabel usage |
| 15,678 | bootstrap_labels | synonyms | ["organic","citroflexb-6","citroflexâ°b-6","morflexâ°b-6"] | [] | Removed legacy synonyms field in favor of structured labels |
| 52,220 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 52,221 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 218,495 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,954 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,955 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,956 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J862.297C","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['82469-79-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[133914, 563248, 21863462, 22446079, 145712238]; selected_pubchem_cids=[133914]; 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 |
| 252,577 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | rdkit_pre_consensus from 'CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)OC(=O)CCC'; added: molecular_mass, monoisotopic_mass |
| 258,279 | consensus_match | altLabel | [] | [{"@value":"1,2,3-Propanetricarboxylic acid, 2-(1-oxobutoxy)-, 1,2,3-trihexyl ester","@language":"en","source":{"prov:w… | group_key=1,2,3-trihexyl2-(butanoyloxy)propane-1,2,3-tricarboxylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=82469-79-2; added Common Chemistry CAS names as altLabel: 1,2,3-Propanetricarboxylic acid, 2-(1-oxobutoxy)-, 1,2,3-trihexyl ester, 1,2,3-Propanetricarboxylic acid, 2-(1-oxobutoxy)-, trihexyl ester, Butyryl tri-<em>n</em>-hexyl citrate, Butyryl trihexyl citrate, Citroflex B 6, Trihexyl butyrylcitrate, Trihexyl citrate butyrate; object_uuid=fo-98dbb1374de8c6a2 |
| 258,280 | consensus_match | cas_match_labels | — | {"82469-79-2":"exactMatch"} | group_key=1,2,3-trihexyl2-(butanoyloxy)propane-1,2,3-tricarboxylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'82469-79-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-98dbb1374de8c6a2: {'82469-79-2': 'exactMatch'} |
| 277,782 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,2,3-trihexyl 2-(butanoyloxy)propane-1,2,3-tricarboxylate' |
| 284,479 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | rdkit_post_consensus from 'CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(OC(=O)CCC)C(=O)OCCCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,828 | dedupe_altlabels | altLabel | [{"@value":"1,2,3-Propanetricarboxylic acid, 2-(1-oxobutoxy)-, 1,2,3-trihexyl ester","@language":"en","source":{"prov:w… | [{"@value":"1,2,3-Propanetricarboxylic acid, 2-(1-oxobutoxy)-, 1,2,3-trihexyl ester","@language":"en","source":{"prov:w… | Deduplicated altLabel values and removed entries matching prefLabel |
| 307,131 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/17a20e1b-95b2-… | associations resolved on the elementary layer |
| 392,128 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H50O8"]… | typed the way the ontology types it |
| 400,447 | 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/20260820T1812399309960000/15676 | prefLabel | ef:agent/bootstrap_labels | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v0 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v1 |
| ef:activity/change/20260820T1812399309960000/15677 | name | ef:agent/bootstrap_labels | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v1 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v2 |
| ef:activity/change/20260820T1812399309960000/15678 | synonyms | ef:agent/bootstrap_labels | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v2 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v3 |
| ef:activity/change/20260820T1812399309960000/52220 | context | ef:agent/default_context_mapping | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v3 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v4 |
| ef:activity/change/20260820T1812399309960000/52221 | context_iri | ef:agent/default_context_mapping | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v4 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v5 |
| ef:activity/change/20260820T1812399309960000/218495 | unit_iri | ef:agent/unit_normalization | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v5 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v6 |
| ef:activity/change/20260820T1812399309960000/241954 | properties | ef:agent/enrich_references | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v6 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v7 |
| ef:activity/change/20260820T1812399309960000/241955 | skos_definition | ef:agent/enrich_references | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v7 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v8 |
| ef:activity/change/20260820T1812399309960000/241956 | references | ef:agent/enrich_references | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v8 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v9 |
| ef:activity/change/20260820T1812399309960000/252577 | properties | ef:agent/rdkit_pre_consensus | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v9 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v10 |
| ef:activity/change/20260820T1812399309960000/258279 | altLabel | ef:agent/consensus_match | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v10 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v11 |
| ef:activity/change/20260820T1812399309960000/258280 | cas_match_labels | ef:agent/consensus_match | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v11 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v12 |
| ef:activity/change/20260820T1812399309960000/277782 | properties | ef:agent/opsin_iupac | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v12 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v13 |
| ef:activity/change/20260820T1812399309960000/284479 | properties | ef:agent/rdkit_post_consensus | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v13 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v14 |
| ef:activity/change/20260820T1812399309960000/292828 | altLabel | ef:agent/dedupe_altlabels | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v14 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v15 |
| ef:activity/change/20260820T1812399309960000/307131 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v15 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v16 |
| ef:activity/change/20260820T1812399309960000/392128 | properties | ef:agent/normalise_property_values | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v16 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v17 |
| ef:activity/change/20260820T1812399309960000/400447 | types | ef:agent/link_flows_to_their_substance | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v17 | ef:flow/17a20e1b-95b2-42b7-8b79-d22e55c6715f/v18 |