Hexadecyl Acrylate
Everything that changed this flow. Back to the flow
5b29374e-d3ff-4659-85fc-ef2b243e1814
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 3 catalogue altLabel value(s): 'CD 585' (grade code), 'NSC 72788' (registry code), 'Photomer 4816' (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=hexadecylacrylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'13402-02-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f3fc55f94bd626e: {'13402-02-3': '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 soil > Emissions to non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['13402-02-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[83410, 189348]; selected_pubchem_cids=[83410]; 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 |
|---|---|---|---|---|---|
| 3,038 | bootstrap_labels | prefLabel | — | [{"@value":"hexadecyl acrylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 3,039 | bootstrap_labels | name | hexadecyl acrylate | — | Purged legacy name field to enforce prefLabel usage |
| 3,040 | bootstrap_labels | synonyms | ["organic","hexadecylacrylate","2-propenoicacid,hexadecylester(9ci)","acrylicacid,hexadecylester(6ci,7ci,8ci)","stearyl… | [] | Removed legacy synonyms field in favor of structured labels |
| 103,902 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 103,903 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 214,353 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,787 | normalize_name_case | prefLabel | [{"@value":"hexadecyl acrylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | [{"@value":"Hexadecyl Acrylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 230,097 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 230,098 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 230,099 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J107.543H","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['13402-02-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[83410, 189348]; selected_pubchem_cids=[83410]; 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 |
| 249,159 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCCOC(=O)C=C'; added: molecular_mass, monoisotopic_mass |
| 267,641 | consensus_match | altLabel | [] | [{"@value":"1-Hexadecanol, acrylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | group_key=hexadecylacrylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=13402-02-3; added Common Chemistry CAS names as altLabel: 1-Hexadecanol, acrylate, 2-Propenoic acid, hexadecyl ester, <em>n</em>-Hexadecyl acrylate, Acrylic acid, hexadecyl ester, Blemmer CA, CD 585, Cetyl acrylate, Hexadecanyl acrylate, Komerate A 169, NSC 72788, Palmityl acrylate, Photomer 4816; object_uuid=fo-5f3fc55f94bd626e |
| 267,642 | consensus_match | cas_match_labels | — | {"13402-02-3":"exactMatch"} | group_key=hexadecylacrylate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'13402-02-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f3fc55f94bd626e: {'13402-02-3': 'exactMatch'} |
| 274,275 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Hexadecyl Acrylate' |
| 280,704 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | rdkit_post_consensus from 'C=CC(=O)OCCCCCCCCCCCCCCCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,850 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Hexadecanol, acrylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | [{"@value":"1-Hexadecanol, acrylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | Removed 3 catalogue altLabel value(s): 'CD 585' (grade code), 'NSC 72788' (registry code), 'Photomer 4816' (trade name) |
| 332,948 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5b29374e-d3ff-… | associations resolved on the elementary layer |
| 388,571 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H36O2"]… | typed the way the ontology types it |
| 395,368 | 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/20260822T0600486828500000/3038 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v0 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v1 |
| ef:activity/change/20260822T0600486828500000/3039 | name | ef:agent/bootstrap_labels | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v1 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v2 |
| ef:activity/change/20260822T0600486828500000/3040 | synonyms | ef:agent/bootstrap_labels | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v2 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v3 |
| ef:activity/change/20260822T0600486828500000/103902 | context | ef:agent/default_context_mapping | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v3 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v4 |
| ef:activity/change/20260822T0600486828500000/103903 | context_iri | ef:agent/default_context_mapping | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v4 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v5 |
| ef:activity/change/20260822T0600486828500000/214353 | unit_iri | ef:agent/unit_normalization | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v5 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v6 |
| ef:activity/change/20260822T0600486828500000/221787 | prefLabel | ef:agent/normalize_name_case | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v6 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v7 |
| ef:activity/change/20260822T0600486828500000/230097 | properties | ef:agent/enrich_references | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v7 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v8 |
| ef:activity/change/20260822T0600486828500000/230098 | skos_definition | ef:agent/enrich_references | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v8 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v9 |
| ef:activity/change/20260822T0600486828500000/230099 | references | ef:agent/enrich_references | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v9 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v10 |
| ef:activity/change/20260822T0600486828500000/249159 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v10 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v11 |
| ef:activity/change/20260822T0600486828500000/267641 | altLabel | ef:agent/consensus_match | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v11 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v12 |
| ef:activity/change/20260822T0600486828500000/267642 | cas_match_labels | ef:agent/consensus_match | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v12 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v13 |
| ef:activity/change/20260822T0600486828500000/274275 | properties | ef:agent/opsin_iupac | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v13 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v14 |
| ef:activity/change/20260822T0600486828500000/280704 | properties | ef:agent/rdkit_post_consensus | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v14 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v15 |
| ef:activity/change/20260822T0600486828500000/287850 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v15 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v16 |
| ef:activity/change/20260822T0600486828500000/332948 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v16 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v17 |
| ef:activity/change/20260822T0600486828500000/388571 | properties | ef:agent/normalise_property_values | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v17 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v18 |
| ef:activity/change/20260822T0600486828500000/395368 | types | ef:agent/link_flows_to_their_substance | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v18 | ef:flow/5b29374e-d3ff-4659-85fc-ef2b243e1814/v19 |