1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane
Everything that changed this flow. Back to the flow
1554d435-2993-44b2-8376-08278671b9a4
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 2 catalogue altLabel value(s): 'Espercarb 1043' (trade name), 'P 16S' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'15520-11-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f30a1094ec9f127: {'15520-11-3': '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 |
| 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=['15520-11-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[84964, 53249337, 57370154]; selected_pubchem_cids=[84964]; 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 |
|---|---|---|---|---|---|
| 14,796 | bootstrap_labels | prefLabel | — | [{"@value":"1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane","@language":"en",… | Bootstrapped prefLabel from legacy name field |
| 14,797 | bootstrap_labels | name | 1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane | — | Purged legacy name field to enforce prefLabel usage |
| 14,798 | bootstrap_labels | synonyms | ["organic","bis(4-tert-butylcyclohexyl)peroxydicarbonate","bchpc","perkadox16"] | [] | Removed legacy synonyms field in favor of structured labels |
| 49,965 | 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 |
| 49,966 | 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 |
| 218,220 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,180 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,181 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,182 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.217G","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['15520-11-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[84964, 53249337, 57370154]; selected_pubchem_cids=[84964]; 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 |
| 252,354 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | rdkit_pre_consensus from 'CC(C)(C)C1CCC(CC1)OC(=O)OOC(=O)OC2CCC(CC2)C(C)(C)C'; added: molecular_mass, monoisotopic_mass |
| 259,320 | consensus_match | altLabel | [] | [{"@value":"BHPC","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-… | group_key=1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane||dimension=Environmental > media=Water > water_body=Surface water; cas=15520-11-3; added Common Chemistry CAS names as altLabel: BHPC, Bis(4-<em>tert</em>-butylcyclohexyl) percarbonate, Bis(4-<em>tert</em>-butylcyclohexyl) peroxydicarbonate, Cyclohexanol, 4-<em>tert</em>-butyl-, peroxydicarbonate (2:1), Di(4-<em>t</em>-butylcyclohexyl) peroxydicarbonate, Di(4-<em>tert</em>-Butylcyclohexyl) peroxydicarbonate, Di(4-<em>tert</em>-butylcyclohexyl) peroxidicarbonate, Di-<em>tert</em>-Butyldicyclohexyl peroxydicarbonate, Espercarb 1043, P 16S, Perkadox 16, Perkadox 16-40PS, Perkadox 16N, Perkadox 16S, Perkadox 16W40, Perkadox PX 16, Peroxydicarbonic acid, <em>C</em>,<em>C</em>′-bis[4-(1,1-dimethylethyl)cyclohexyl] ester, Peroxydicarbonic acid, bis(4-<em>tert</em>-butylcyclohexyl) ester, Peroxydicarbonic acid, bis[4-(1,1-dimethylethyl)cyclohexyl] ester, Peroyl TCP; object_uuid=fo-7f30a1094ec9f127 |
| 259,321 | consensus_match | cas_match_labels | — | {"15520-11-3":"exactMatch"} | group_key=1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'15520-11-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f30a1094ec9f127: {'15520-11-3': 'exactMatch'} |
| 277,546 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-tert-butyl-4-{[({[(4-tert-butylcyclohexyl)oxy]carbonyl}peroxy)carbonyl]oxy}cyclohexane' |
| 284,241 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | rdkit_post_consensus from 'CC(C)(C)C1CCC(OC(=O)OOC(=O)OC2CCC(C(C)(C)C)CC2)CC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,299 | strip_catalogue_altlabels | altLabel | [{"@value":"BHPC","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-… | [{"@value":"BHPC","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-… | Removed 2 catalogue altLabel value(s): 'Espercarb 1043' (trade name), 'P 16S' (grade code) |
| 306,048 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1554d435-2993-… | associations resolved on the elementary layer |
| 391,929 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H38O6"]… | typed the way the ontology types it |
| 400,162 | 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/20260920T1042228874600000/14796 | prefLabel | ef:agent/bootstrap_labels | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v0 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v1 |
| ef:activity/change/20260920T1042228874600000/14797 | name | ef:agent/bootstrap_labels | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v1 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v2 |
| ef:activity/change/20260920T1042228874600000/14798 | synonyms | ef:agent/bootstrap_labels | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v2 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v3 |
| ef:activity/change/20260920T1042228874600000/49965 | context | ef:agent/default_context_mapping | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v3 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v4 |
| ef:activity/change/20260920T1042228874600000/49966 | context_iri | ef:agent/default_context_mapping | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v4 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v5 |
| ef:activity/change/20260920T1042228874600000/218220 | unit_iri | ef:agent/unit_normalization | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v5 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v6 |
| ef:activity/change/20260920T1042228874600000/241180 | properties | ef:agent/enrich_references | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v6 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v7 |
| ef:activity/change/20260920T1042228874600000/241181 | skos_definition | ef:agent/enrich_references | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v7 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v8 |
| ef:activity/change/20260920T1042228874600000/241182 | references | ef:agent/enrich_references | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v8 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v9 |
| ef:activity/change/20260920T1042228874600000/252354 | properties | ef:agent/rdkit_pre_consensus | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v9 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v10 |
| ef:activity/change/20260920T1042228874600000/259320 | altLabel | ef:agent/consensus_match | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v10 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v11 |
| ef:activity/change/20260920T1042228874600000/259321 | cas_match_labels | ef:agent/consensus_match | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v11 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v12 |
| ef:activity/change/20260920T1042228874600000/277546 | properties | ef:agent/opsin_iupac | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v12 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v13 |
| ef:activity/change/20260920T1042228874600000/284241 | properties | ef:agent/rdkit_post_consensus | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v13 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v14 |
| ef:activity/change/20260920T1042228874600000/290299 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v14 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v15 |
| ef:activity/change/20260920T1042228874600000/306048 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v15 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v16 |
| ef:activity/change/20260920T1042228874600000/391929 | properties | ef:agent/normalise_property_values | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v16 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v17 |
| ef:activity/change/20260920T1042228874600000/400162 | types | ef:agent/link_flows_to_their_substance | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v17 | ef:flow/1554d435-2993-44b2-8376-08278671b9a4/v18 |