Pentachlorophenyl Laurate
Everything that changed this flow. Back to the flow
890800ad-0bcc-447f-8607-b734a5e1b0a3
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, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 77542' (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=pentachlorophenyllaurate||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'3772-94-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ea0c7ca6c6d1a529: {'3772-94-9': '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 water, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['3772-94-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[62524]; selected_pubchem_cids=[62524]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 22,942 | bootstrap_labels | prefLabel | — | [{"@value":"pentachlorophenyl laurate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Bootstrapped prefLabel from legacy name field |
| 22,943 | bootstrap_labels | name | pentachlorophenyl laurate | — | Purged legacy name field to enforce prefLabel usage |
| 22,944 | bootstrap_labels | synonyms | ["(2,3,4,5,6-pentachlorophenyl) dodecanoate","AC1L1XAE","Dodecanoic acid, 2,3,4,5,6-pentachlorophenyl ester","Dodecanoi… | [] | Removed legacy synonyms field in favor of structured labels |
| 131,208 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 131,209 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 220,591 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,239 | normalize_name_case | prefLabel | [{"@value":"pentachlorophenyl laurate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | [{"@value":"Pentachlorophenyl Laurate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 247,761 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 247,762 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 247,763 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J60.229I","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['3772-94-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[62524]; selected_pubchem_cids=[62524]; 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 |
| 254,255 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | rdkit_pre_consensus from 'CCCCCCCCCCCC(=O)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl'; added: molecular_mass, monoisotopic_mass |
| 270,425 | consensus_match | altLabel | [] | [{"@value":"Dodecanoic acid, 2,3,4,5,6-pentachlorophenyl ester","@language":"en","source":{"prov:wasGeneratedBy":"conse… | group_key=pentachlorophenyllaurate||dimension=Environmental > media=Air > strata=Long-term; cas=3772-94-9; added Common Chemistry CAS names as altLabel: Dodecanoic acid, 2,3,4,5,6-pentachlorophenyl ester, Dodecanoic acid, pentachlorophenyl ester, Lauric acid, pentachlorophenyl ester, Lauroyl pentachlorophenate, Mystox, Mystox LPL, Mystox LSD, Mystox LSL, NSC 77542, Pentachlorophenol laurate, Phenol, pentachloro-, laurate; object_uuid=fo-ea0c7ca6c6d1a529 |
| 270,426 | consensus_match | cas_match_labels | — | {"3772-94-9":"exactMatch"} | group_key=pentachlorophenyllaurate||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'3772-94-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ea0c7ca6c6d1a529: {'3772-94-9': 'exactMatch'} |
| 279,485 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Pentachlorophenyl Laurate' |
| 286,362 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | rdkit_post_consensus from 'CCCCCCCCCCCC(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,702 | strip_catalogue_altlabels | altLabel | [{"@value":"Dodecanoic acid, 2,3,4,5,6-pentachlorophenyl ester","@language":"en","source":{"prov:wasGeneratedBy":"conse… | [{"@value":"Dodecanoic acid, 2,3,4,5,6-pentachlorophenyl ester","@language":"en","source":{"prov:wasGeneratedBy":"conse… | Removed 1 catalogue altLabel value(s): 'NSC 77542' (registry code) |
| 346,604 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/890800ad-0bcc-… | associations resolved on the elementary layer |
| 393,879 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H23Cl5O… | typed the way the ontology types it |
| 403,092 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260822T0600486828500000/22942 | prefLabel | ef:agent/bootstrap_labels | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v0 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v1 |
| ef:activity/change/20260822T0600486828500000/22943 | name | ef:agent/bootstrap_labels | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v1 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v2 |
| ef:activity/change/20260822T0600486828500000/22944 | synonyms | ef:agent/bootstrap_labels | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v2 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v3 |
| ef:activity/change/20260822T0600486828500000/131208 | context | ef:agent/default_context_mapping | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v3 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v4 |
| ef:activity/change/20260822T0600486828500000/131209 | context_iri | ef:agent/default_context_mapping | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v4 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v5 |
| ef:activity/change/20260822T0600486828500000/220591 | unit_iri | ef:agent/unit_normalization | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v5 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v6 |
| ef:activity/change/20260822T0600486828500000/226239 | prefLabel | ef:agent/normalize_name_case | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v6 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v7 |
| ef:activity/change/20260822T0600486828500000/247761 | properties | ef:agent/enrich_references | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v7 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v8 |
| ef:activity/change/20260822T0600486828500000/247762 | skos_definition | ef:agent/enrich_references | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v8 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v9 |
| ef:activity/change/20260822T0600486828500000/247763 | references | ef:agent/enrich_references | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v9 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v10 |
| ef:activity/change/20260822T0600486828500000/254255 | properties | ef:agent/rdkit_pre_consensus | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v10 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v11 |
| ef:activity/change/20260822T0600486828500000/270425 | altLabel | ef:agent/consensus_match | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v11 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v12 |
| ef:activity/change/20260822T0600486828500000/270426 | cas_match_labels | ef:agent/consensus_match | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v12 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v13 |
| ef:activity/change/20260822T0600486828500000/279485 | properties | ef:agent/opsin_iupac | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v13 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v14 |
| ef:activity/change/20260822T0600486828500000/286362 | properties | ef:agent/rdkit_post_consensus | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v14 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v15 |
| ef:activity/change/20260822T0600486828500000/291702 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v15 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v16 |
| ef:activity/change/20260822T0600486828500000/346604 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v16 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v17 |
| ef:activity/change/20260822T0600486828500000/393879 | properties | ef:agent/normalise_property_values | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v17 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v18 |
| ef:activity/change/20260822T0600486828500000/403092 | types | ef:agent/link_flows_to_their_substance | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v18 | ef:flow/890800ad-0bcc-447f-8607-b734a5e1b0a3/v19 |