Docosyl Acrylate
Everything that changed this flow. Back to the flow
94efbb1b-ea52-46dd-8bf7-8d52dd765071
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): 'CD 587' (grade code), 'Photomer 4822' (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=docosylacrylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18299-85-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c5487cf7761c4b30: {'18299-85-9': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['18299-85-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[87388, 87565]; selected_pubchem_cids=[87565]; 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 |
|---|---|---|---|---|---|
| 1,784 | bootstrap_labels | prefLabel | — | [{"@value":"docosyl acrylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 1,785 | bootstrap_labels | name | docosyl acrylate | — | Purged legacy name field to enforce prefLabel usage |
| 1,786 | bootstrap_labels | synonyms | ["organic","docosylacrylate","2-propenoicacid,docosylester(9ci)","acrylicacid,dosocylester(6ci,7ci,8ci)","behenylacryla… | [] | Removed legacy synonyms field in favor of structured labels |
| 138,292 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 138,293 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 213,939 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,514 | normalize_name_case | prefLabel | [{"@value":"docosyl acrylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Docosyl Acrylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,905 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,906 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,907 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J266.108J","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['18299-85-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[87388, 87565]; selected_pubchem_cids=[87565]; 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 |
| 248,819 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=C'; added: molecular_mass, monoisotopic_mass |
| 266,605 | consensus_match | altLabel | [] | [{"@value":"1-Docosanol, acrylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | group_key=docosylacrylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=18299-85-9; added Common Chemistry CAS names as altLabel: 1-Docosanol, acrylate, 2-Propenoic acid, docosyl ester, A-BH, A-BH (acrylate), Acrylic acid, docosyl ester, Behenyl acrylate, Blemmer VA, CD 587, Komerate A 229, NK Ester A-BH, Nacol 2233 Ester, Photomer 4822; object_uuid=fo-c5487cf7761c4b30 |
| 266,606 | consensus_match | cas_match_labels | — | {"18299-85-9":"exactMatch"} | group_key=docosylacrylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18299-85-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c5487cf7761c4b30: {'18299-85-9': 'exactMatch'} |
| 273,956 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Docosyl Acrylate' |
| 280,353 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | rdkit_post_consensus from 'C=CC(=O)OCCCCCCCCCCCCCCCCCCCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,632 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Docosanol, acrylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | [{"@value":"1-Docosanol, acrylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | Removed 2 catalogue altLabel value(s): 'CD 587' (grade code), 'Photomer 4822' (trade name) |
| 350,169 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/94efbb1b-ea52-… | associations resolved on the elementary layer |
| 388,247 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C25H48O2"]… | typed the way the ontology types it |
| 394,890 | 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/20260820T1555490862250000/1784 | prefLabel | ef:agent/bootstrap_labels | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v0 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v1 |
| ef:activity/change/20260820T1555490862250000/1785 | name | ef:agent/bootstrap_labels | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v1 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v2 |
| ef:activity/change/20260820T1555490862250000/1786 | synonyms | ef:agent/bootstrap_labels | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v2 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v3 |
| ef:activity/change/20260820T1555490862250000/138292 | context | ef:agent/default_context_mapping | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v3 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v4 |
| ef:activity/change/20260820T1555490862250000/138293 | context_iri | ef:agent/default_context_mapping | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v4 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v5 |
| ef:activity/change/20260820T1555490862250000/213939 | unit_iri | ef:agent/unit_normalization | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v5 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v6 |
| ef:activity/change/20260820T1555490862250000/221514 | prefLabel | ef:agent/normalize_name_case | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v6 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v7 |
| ef:activity/change/20260820T1555490862250000/228905 | properties | ef:agent/enrich_references | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v7 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v8 |
| ef:activity/change/20260820T1555490862250000/228906 | skos_definition | ef:agent/enrich_references | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v8 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v9 |
| ef:activity/change/20260820T1555490862250000/228907 | references | ef:agent/enrich_references | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v9 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v10 |
| ef:activity/change/20260820T1555490862250000/248819 | properties | ef:agent/rdkit_pre_consensus | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v10 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v11 |
| ef:activity/change/20260820T1555490862250000/266605 | altLabel | ef:agent/consensus_match | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v11 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v12 |
| ef:activity/change/20260820T1555490862250000/266606 | cas_match_labels | ef:agent/consensus_match | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v12 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v13 |
| ef:activity/change/20260820T1555490862250000/273956 | properties | ef:agent/opsin_iupac | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v13 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v14 |
| ef:activity/change/20260820T1555490862250000/280353 | properties | ef:agent/rdkit_post_consensus | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v14 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v15 |
| ef:activity/change/20260820T1555490862250000/287632 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v15 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v16 |
| ef:activity/change/20260820T1555490862250000/350169 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v16 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v17 |
| ef:activity/change/20260820T1555490862250000/388247 | properties | ef:agent/normalise_property_values | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v17 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v18 |
| ef:activity/change/20260820T1555490862250000/394890 | types | ef:agent/link_flows_to_their_substance | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v18 | ef:flow/94efbb1b-ea52-46dd-8bf7-8d52dd765071/v19 |