2-phenylethyl Phenylacetate
Everything that changed this flow. Back to the flow
fe050ff6-1404-4b9d-817f-4d8094190bea
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 6676' (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=2-phenylethylphenylacetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'102-20-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-aec6955f9d255727: {'102-20-5': '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 air > Emissions to air, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['102-20-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_173735']; candidate_pubchem_cids=[7601, 3575596]; selected_pubchem_cids=[7601]; 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 |
|---|---|---|---|---|---|
| 5,414 | bootstrap_labels | prefLabel | — | [{"@value":"2-phenylethyl phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Bootstrapped prefLabel from legacy name field |
| 5,415 | bootstrap_labels | name | 2-phenylethyl phenylacetate | — | Purged legacy name field to enforce prefLabel usage |
| 5,416 | bootstrap_labels | synonyms | ["organic","phenethylphenylacetate","phenylethylphenylacetate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 202,354 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 202,355 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 215,146 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,349 | normalize_name_case | prefLabel | [{"@value":"2-phenylethyl phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | [{"@value":"2-phenylethyl Phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,381 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,382 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,383 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J74.787D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['102-20-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_173735']; candidate_pubchem_cids=[7601, 3575596]; selected_pubchem_cids=[7601]; 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 |
| 255,062 | chebi_altlabels | altLabel | [] | [{"@value":"2-phenylethyl 2-phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | Added 1 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 261,283 | consensus_match | altLabel | [{"@value":"2-phenylethyl 2-phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"2-phenylethyl 2-phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | group_key=2-phenylethylphenylacetate||dimension=Environmental > media=Water > water_body=Unknown; cas=102-20-5; added Common Chemistry CAS names as altLabel: 2-Phenylethyl 2-phenylethanoate, Acetic acid, phenyl-, phenethyl ester, Benzeneacetic acid, 2-phenylethyl ester, Benzylcarbinyl α-toluate, NSC 6676, Phenethyl 2-phenylacetate, Phenethyl phenylacetate, Phenylethyl phenylacetate, β-Phenylethyl phenylacetate; object_uuid=fo-aec6955f9d255727 |
| 261,284 | consensus_match | cas_match_labels | — | {"102-20-5":"exactMatch"} | group_key=2-phenylethylphenylacetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'102-20-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-aec6955f9d255727: {'102-20-5': 'exactMatch'} |
| 274,949 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-phenylethyl Phenylacetate' |
| 281,429 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | rdkit_post_consensus from 'O=C(Cc1ccccc1)OCCc1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,359 | strip_catalogue_altlabels | altLabel | [{"@value":"2-phenylethyl 2-phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"2-phenylethyl 2-phenylacetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | Removed 1 catalogue altLabel value(s): 'NSC 6676' (registry code) |
| 382,211 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fe050ff6-1404-… | associations resolved on the elementary layer |
| 389,256 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H16O2"]… | typed the way the ontology types it |
| 396,325 | 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/20260821T1302361922970000/5414 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v0 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v1 |
| ef:activity/change/20260821T1302361922970000/5415 | name | ef:agent/bootstrap_labels | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v1 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v2 |
| ef:activity/change/20260821T1302361922970000/5416 | synonyms | ef:agent/bootstrap_labels | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v2 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v3 |
| ef:activity/change/20260821T1302361922970000/202354 | context | ef:agent/default_context_mapping | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v3 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v4 |
| ef:activity/change/20260821T1302361922970000/202355 | context_iri | ef:agent/default_context_mapping | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v4 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v5 |
| ef:activity/change/20260821T1302361922970000/215146 | unit_iri | ef:agent/unit_normalization | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v5 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v6 |
| ef:activity/change/20260821T1302361922970000/222349 | prefLabel | ef:agent/normalize_name_case | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v6 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v7 |
| ef:activity/change/20260821T1302361922970000/232381 | properties | ef:agent/enrich_references | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v7 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v8 |
| ef:activity/change/20260821T1302361922970000/232382 | skos_definition | ef:agent/enrich_references | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v8 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v9 |
| ef:activity/change/20260821T1302361922970000/232383 | references | ef:agent/enrich_references | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v9 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v10 |
| ef:activity/change/20260821T1302361922970000/255062 | altLabel | ef:agent/chebi_altlabels | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v10 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v11 |
| ef:activity/change/20260821T1302361922970000/261283 | altLabel | ef:agent/consensus_match | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v11 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v12 |
| ef:activity/change/20260821T1302361922970000/261284 | cas_match_labels | ef:agent/consensus_match | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v12 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v13 |
| ef:activity/change/20260821T1302361922970000/274949 | properties | ef:agent/opsin_iupac | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v13 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v14 |
| ef:activity/change/20260821T1302361922970000/281429 | properties | ef:agent/rdkit_post_consensus | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v14 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v15 |
| ef:activity/change/20260821T1302361922970000/288359 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v15 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v16 |
| ef:activity/change/20260821T1302361922970000/382211 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v16 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v17 |
| ef:activity/change/20260821T1302361922970000/389256 | properties | ef:agent/normalise_property_values | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v17 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v18 |
| ef:activity/change/20260821T1302361922970000/396325 | types | ef:agent/link_flows_to_their_substance | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v18 | ef:flow/fe050ff6-1404-4b9d-817f-4d8094190bea/v19 |