Glycerol Trioctanoate
Everything that changed this flow. Back to the flow
8bad7866-d5ee-4378-a558-bbfdf5f827a4
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 10 catalogue altLabel value(s): 'CER 0001' (grade code), 'Captex 8000' (trade name), 'Delios 888' (trade name), 'Miglyol 808' (trade name), 'Myritol 888' (trade name), 'NI 01' (grade code), 'NSC 4059' (registry code), 'Paester 9306' (trade name), 'Panacet 800' (trade name), 'Sefsol 810' (trade name) |
| 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=glyceroltrioctanoate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'538-23-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-74a6c503b05500de: {'538-23-8': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['538-23-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_76978']; candidate_pubchem_cids=[10850]; selected_pubchem_cids=[10850]; 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 |
|---|---|---|---|---|---|
| 13,607 | bootstrap_labels | prefLabel | — | [{"@value":"glycerol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Bootstrapped prefLabel from legacy name field |
| 13,608 | bootstrap_labels | name | glycerol trioctanoate | — | Purged legacy name field to enforce prefLabel usage |
| 13,609 | bootstrap_labels | synonyms | ["1,2,3-Propanetriol trioctanoate","1,2,3-Tri-n-octanoylglycerol","1,2,3-Tricapryloylglycerol","1,2,3-Trioctanoylglycer… | [] | Removed legacy synonyms field in favor of structured labels |
| 132,880 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 132,881 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 217,834 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,245 | normalize_name_case | prefLabel | [{"@value":"glycerol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | [{"@value":"Glycerol Trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,071 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 240,072 | enrich_references | skos_definition | — | [{"@value":"A triglyceride obtained by acylation of the three hydroxy groups of glycerol by octanoic acid. Used as an a… | Merged ChEBI/PubChem definitions into skos:definition |
| 240,073 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J54.226A","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['538-23-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_76978']; candidate_pubchem_cids=[10850]; selected_pubchem_cids=[10850]; 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 |
| 252,024 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | rdkit_pre_consensus from 'CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC'; added: monoisotopic_mass |
| 256,226 | chebi_altlabels | altLabel | [] | [{"@value":"1,2,3-Propanetriol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:w… | Added 23 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 267,439 | consensus_match | altLabel | [{"@value":"1,2,3-Propanetriol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:w… | [{"@value":"1,2,3-Propanetriol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:w… | group_key=glyceroltrioctanoate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=538-23-8; added Common Chemistry CAS names as altLabel: 2,3-Di(octanoyloxy)propyl octanoate, CER 0001, Captex 8000, Coconad RK, Delios 888, Emalex KTG, Glycerin trioctanoate, Glyceryl trioctanoate, Hest TC, Hexalan, Miglyol 808, Myritol 888, NI 01, NSC 4059, Octanoic acid, 1,1′,1′′-(1,2,3-propanetriyl) ester, Octanoin, tri-, Paester 9306, Panacet 800, Poem M 2, RATO, Rilanit GTC, Sefsol 810, Stelliesters 55/45, Stelliesters MCT 55/45, Trioctanoin, Trivent OCG; object_uuid=fo-74a6c503b05500de |
| 267,440 | consensus_match | cas_match_labels | — | {"538-23-8":"exactMatch"} | group_key=glyceroltrioctanoate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'538-23-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-74a6c503b05500de: {'538-23-8': 'exactMatch'} |
| 277,224 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Glycerol Trioctanoate' |
| 283,888 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | rdkit_post_consensus from 'CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,047 | strip_catalogue_altlabels | altLabel | [{"@value":"1,2,3-Propanetriol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:w… | [{"@value":"1,2,3-Propanetriol trioctanoate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:w… | Removed 10 catalogue altLabel value(s): 'CER 0001' (grade code), 'Captex 8000' (trade name), 'Delios 888' (trade name), 'Miglyol 808' (trade name), 'Myritol 888' (trade name), 'NI 01' (grade code), 'NSC 4059' (registry code), 'Paester 9306' (trade name), 'Panacet 800' (trade name), 'Sefsol 810' (trade name) |
| 347,435 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8bad7866-d5ee-… | associations resolved on the elementary layer |
| 391,571 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H50O6"]… | typed the way the ontology types it |
| 399,667 | 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/20260822T0600486828500000/13607 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v0 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v1 |
| ef:activity/change/20260822T0600486828500000/13608 | name | ef:agent/bootstrap_labels | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v1 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v2 |
| ef:activity/change/20260822T0600486828500000/13609 | synonyms | ef:agent/bootstrap_labels | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v2 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v3 |
| ef:activity/change/20260822T0600486828500000/132880 | context | ef:agent/default_context_mapping | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v3 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v4 |
| ef:activity/change/20260822T0600486828500000/132881 | context_iri | ef:agent/default_context_mapping | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v4 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v5 |
| ef:activity/change/20260822T0600486828500000/217834 | unit_iri | ef:agent/unit_normalization | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v5 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v6 |
| ef:activity/change/20260822T0600486828500000/224245 | prefLabel | ef:agent/normalize_name_case | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v6 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v7 |
| ef:activity/change/20260822T0600486828500000/240071 | properties | ef:agent/enrich_references | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v7 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v8 |
| ef:activity/change/20260822T0600486828500000/240072 | skos_definition | ef:agent/enrich_references | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v8 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v9 |
| ef:activity/change/20260822T0600486828500000/240073 | references | ef:agent/enrich_references | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v9 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v10 |
| ef:activity/change/20260822T0600486828500000/252024 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v10 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v11 |
| ef:activity/change/20260822T0600486828500000/256226 | altLabel | ef:agent/chebi_altlabels | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v11 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v12 |
| ef:activity/change/20260822T0600486828500000/267439 | altLabel | ef:agent/consensus_match | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v12 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v13 |
| ef:activity/change/20260822T0600486828500000/267440 | cas_match_labels | ef:agent/consensus_match | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v13 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v14 |
| ef:activity/change/20260822T0600486828500000/277224 | properties | ef:agent/opsin_iupac | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v14 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v15 |
| ef:activity/change/20260822T0600486828500000/283888 | properties | ef:agent/rdkit_post_consensus | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v15 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v16 |
| ef:activity/change/20260822T0600486828500000/290047 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v16 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v17 |
| ef:activity/change/20260822T0600486828500000/347435 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v17 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v18 |
| ef:activity/change/20260822T0600486828500000/391571 | properties | ef:agent/normalise_property_values | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v18 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v19 |
| ef:activity/change/20260822T0600486828500000/399667 | types | ef:agent/link_flows_to_their_substance | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v19 | ef:flow/8bad7866-d5ee-4378-a558-bbfdf5f827a4/v20 |