Glycerol Octanoate Decanoate
Everything that changed this flow. Back to the flow
37fc3024-07a4-4f6b-8cbf-e3463be839b7
By field
14 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=glyceroloctanoatedecanoate||dimension=Environmental > media=Water > water_body=Unknown; cas=65381-09-1; added Common Chemistry CAS names as altLabel: Decanoic acid, ester with 1,2,3-propanetriol octanoate, Glyceryl caprylate caprate; object_uuid=fo-0b0d3a111f7d7db2 |
| cas_match_labels | 1 | consensus_match | group_key=glyceroloctanoatedecanoate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'65381-09-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0b0d3a111f7d7db2: {'65381-09-1': '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 fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 265-724-3 from CAS 65381-09-1 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['65381-09-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[15735, 93356, 16205909, 19026760, 90474509, 119025424, 175675666]; selected_pubchem_cids=[93356]; 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 |
|---|---|---|---|---|---|
| 2,444 | bootstrap_labels | prefLabel | — | [{"@value":"Glycerol octanoate decanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Bootstrapped prefLabel from legacy name field |
| 2,445 | bootstrap_labels | name | Glycerol octanoate decanoate | — | Purged legacy name field to enforce prefLabel usage |
| 2,446 | bootstrap_labels | synonyms | ["AC1L3Q1D","AC1Q5W7V","Caprylic acid, capric acid triglyceride","Caprylic acid, capric acid, triglyceride","Caprylic/c… | [] | Removed legacy synonyms field in favor of structured labels |
| 73,866 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 73,867 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 214,154 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,651 | normalize_name_case | prefLabel | [{"@value":"Glycerol octanoate decanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | [{"@value":"Glycerol Octanoate Decanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 226,726 | ec_cross_check | ec_numbers | [] | ["265-724-3"] | Resolved from EC-inventory: 265-724-3 from CAS 65381-09-1 |
| 229,529 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,530 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,531 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.079.132","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['65381-09-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[15735, 93356, 16205909, 19026760, 90474509, 119025424, 175675666]; selected_pubchem_cids=[93356]; 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 |
| 248,994 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | rdkit_pre_consensus from 'CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.C(C(CO)O)O'; added: molecular_mass, monoisotopic_mass |
| 267,437 | consensus_match | altLabel | [] | [{"@value":"Decanoic acid, ester with 1,2,3-propanetriol octanoate","@language":"en","source":{"prov:wasGeneratedBy":"c… | group_key=glyceroloctanoatedecanoate||dimension=Environmental > media=Water > water_body=Unknown; cas=65381-09-1; added Common Chemistry CAS names as altLabel: Decanoic acid, ester with 1,2,3-propanetriol octanoate, Glyceryl caprylate caprate; object_uuid=fo-0b0d3a111f7d7db2 |
| 267,438 | consensus_match | cas_match_labels | — | {"65381-09-1":"exactMatch"} | group_key=glyceroloctanoatedecanoate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'65381-09-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0b0d3a111f7d7db2: {'65381-09-1': 'exactMatch'} |
| 280,529 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | rdkit_post_consensus from 'CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.C(C(CO)O)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 317,949 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/37fc3024-07a4-… | associations resolved on the elementary layer |
| 388,406 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H44O7"]… | typed the way the ontology types it |
| 395,127 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | 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/20260822T0600486828500000/2444 | prefLabel | ef:agent/bootstrap_labels | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v0 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v1 |
| ef:activity/change/20260822T0600486828500000/2445 | name | ef:agent/bootstrap_labels | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v1 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v2 |
| ef:activity/change/20260822T0600486828500000/2446 | synonyms | ef:agent/bootstrap_labels | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v2 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v3 |
| ef:activity/change/20260822T0600486828500000/73866 | context | ef:agent/default_context_mapping | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v3 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v4 |
| ef:activity/change/20260822T0600486828500000/73867 | context_iri | ef:agent/default_context_mapping | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v4 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v5 |
| ef:activity/change/20260822T0600486828500000/214154 | unit_iri | ef:agent/unit_normalization | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v5 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v6 |
| ef:activity/change/20260822T0600486828500000/221651 | prefLabel | ef:agent/normalize_name_case | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v6 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v7 |
| ef:activity/change/20260822T0600486828500000/226726 | ec_numbers | ef:agent/ec_cross_check | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v7 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v8 |
| ef:activity/change/20260822T0600486828500000/229529 | properties | ef:agent/enrich_references | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v8 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v9 |
| ef:activity/change/20260822T0600486828500000/229530 | skos_definition | ef:agent/enrich_references | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v9 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v10 |
| ef:activity/change/20260822T0600486828500000/229531 | references | ef:agent/enrich_references | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v10 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v11 |
| ef:activity/change/20260822T0600486828500000/248994 | properties | ef:agent/rdkit_pre_consensus | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v11 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v12 |
| ef:activity/change/20260822T0600486828500000/267437 | altLabel | ef:agent/consensus_match | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v12 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v13 |
| ef:activity/change/20260822T0600486828500000/267438 | cas_match_labels | ef:agent/consensus_match | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v13 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v14 |
| ef:activity/change/20260822T0600486828500000/280529 | properties | ef:agent/rdkit_post_consensus | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v14 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v15 |
| ef:activity/change/20260822T0600486828500000/317949 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v15 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v16 |
| ef:activity/change/20260822T0600486828500000/388406 | properties | ef:agent/normalise_property_values | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v16 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v17 |
| ef:activity/change/20260822T0600486828500000/395127 | types | ef:agent/link_flows_to_their_substance | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v17 | ef:flow/37fc3024-07a4-4f6b-8cbf-e3463be839b7/v18 |