1-Phenylethylamine
Everything that changed this flow. Back to the flow
1940b3b3-47e8-462a-aa0c-803f70a62843
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 8391' (registry code) |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=618-36-0; cc_chebi_agreed_name='1-Phenylethylamine'; object_uuid=fo-b4986debdaa5cfe8 |
| cas_match_labels | 1 | consensus_match | group_key=1-phenylethanamine||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory']; cas_sources={'618-36-0': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-b4986debdaa5cfe8: {'618-36-0': '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=['618-36-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_670']; candidate_pubchem_cids=[7408, 28125545]; selected_pubchem_cids=[7408]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,777 | bootstrap_labels | prefLabel | — | [{"@value":"1-phenylethanamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 5,778 | bootstrap_labels | name | 1-phenylethanamine | — | Purged legacy name field to enforce prefLabel usage |
| 5,779 | bootstrap_labels | synonyms | ["organic","dl-î±-methylbenzylamine"] | [] | Removed legacy synonyms field in favor of structured labels |
| 53,182 | 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 |
| 53,183 | 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 |
| 215,268 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,739 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,740 | enrich_references | skos_definition | — | [{"@value":"A phenylethylamine that is ethylamine substituted by a phenyl group at position 1.","@language":"en","prove… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,741 | enrich_references | references | [] | [{"@id":"gmelin:26723","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"cons… | Added references with provenance; cas_numbers=['618-36-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_670']; candidate_pubchem_cids=[7408, 28125545]; selected_pubchem_cids=[7408]; 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 |
| 249,917 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | rdkit_pre_consensus from 'CC(C1=CC=CC=C1)N'; added: monoisotopic_mass |
| 255,106 | chebi_altlabels | altLabel | [] | [{"@value":"1-Phenylethylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | Added 7 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 259,297 | consensus_match | prefLabel | [{"@value":"1-phenylethanamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | [{"@value":"1-Phenylethylamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedT… | cas=618-36-0; cc_chebi_agreed_name='1-Phenylethylamine'; object_uuid=fo-b4986debdaa5cfe8 |
| 259,298 | consensus_match | altLabel | [{"@value":"1-Phenylethylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedT… | [{"@value":"1-amino-1-phenylethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | cas=618-36-0; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-b4986debdaa5cfe8 |
| 259,299 | consensus_match | altLabel | [{"@value":"1-amino-1-phenylethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | [{"@value":"1-amino-1-phenylethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | group_key=1-phenylethanamine||dimension=Environmental > media=Water > water_body=Long-term; cas=618-36-0; added Common Chemistry CAS names as altLabel: (1-Aminoethyl)benzene, (<em>RS</em>)-1-Phenylethylamine, (<em>RS</em>)-α-Methylbenzylamine, (±)-1-Amino-1-phenylethane, (±)-1-Phenethylamine, (±)-1-Phenylethylamine, (±)-Phenylethylamine, (±)-α-Methylbenzenemethanamine, (±)-α-Methylbenzylamine, (±)-α-Phenethylamine, (±)-α-Phenylethylamine, 1-Phenyl-1-ethanamine, <em>dl</em>-1-Phenylethylamine, <em>dl</em>-α-Methylbenzylamine, <em>dl</em>-α-Phenethylamine, <em>dl</em>-α-Phenylethylamine, APEA, Benzenemethanamine, α-methyl-, Benzenemethanamine, α-methyl-, (±)-, Benzylamine, α-methyl-, (±)-, Benzylamine, α-methyl-, <em>dl</em>-, Ethanamine, 1-phenyl-, NSC 8391, α-Aminoethylbenzene, α-Methylbenzenemethanamine, α-Methylbenzylamine, α-Phenethylamine, α-Phenylethylamine; object_uuid=fo-b4986debdaa5cfe8 |
| 259,300 | consensus_match | cas_match_labels | — | {"618-36-0":"exactMatch"} | group_key=1-phenylethanamine||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory']; cas_sources={'618-36-0': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-b4986debdaa5cfe8: {'618-36-0': 'exactMatch'} |
| 275,050 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-Phenylethylamine' |
| 281,538 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | rdkit_post_consensus from 'CC(N)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,422 | strip_catalogue_altlabels | altLabel | [{"@value":"1-amino-1-phenylethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | [{"@value":"1-amino-1-phenylethane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribu… | Removed 1 catalogue altLabel value(s): 'NSC 8391' (registry code) |
| 307,611 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1940b3b3-47e8-… | associations resolved on the elementary layer |
| 389,353 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H11N"],"… | typed the way the ontology types it |
| 396,464 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260820T1812399309960000/5777 | prefLabel | ef:agent/bootstrap_labels | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v0 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v1 |
| ef:activity/change/20260820T1812399309960000/5778 | name | ef:agent/bootstrap_labels | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v1 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v2 |
| ef:activity/change/20260820T1812399309960000/5779 | synonyms | ef:agent/bootstrap_labels | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v2 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v3 |
| ef:activity/change/20260820T1812399309960000/53182 | context | ef:agent/default_context_mapping | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v3 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v4 |
| ef:activity/change/20260820T1812399309960000/53183 | context_iri | ef:agent/default_context_mapping | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v4 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v5 |
| ef:activity/change/20260820T1812399309960000/215268 | unit_iri | ef:agent/unit_normalization | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v5 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v6 |
| ef:activity/change/20260820T1812399309960000/232739 | properties | ef:agent/enrich_references | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v6 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v7 |
| ef:activity/change/20260820T1812399309960000/232740 | skos_definition | ef:agent/enrich_references | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v7 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v8 |
| ef:activity/change/20260820T1812399309960000/232741 | references | ef:agent/enrich_references | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v8 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v9 |
| ef:activity/change/20260820T1812399309960000/249917 | properties | ef:agent/rdkit_pre_consensus | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v9 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v10 |
| ef:activity/change/20260820T1812399309960000/255106 | altLabel | ef:agent/chebi_altlabels | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v10 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v11 |
| ef:activity/change/20260820T1812399309960000/259297 | prefLabel | ef:agent/consensus_match | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v11 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v12 |
| ef:activity/change/20260820T1812399309960000/259298 | altLabel | ef:agent/consensus_match | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v12 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v13 |
| ef:activity/change/20260820T1812399309960000/259299 | altLabel | ef:agent/consensus_match | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v13 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v14 |
| ef:activity/change/20260820T1812399309960000/259300 | cas_match_labels | ef:agent/consensus_match | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v14 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v15 |
| ef:activity/change/20260820T1812399309960000/275050 | properties | ef:agent/opsin_iupac | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v15 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v16 |
| ef:activity/change/20260820T1812399309960000/281538 | properties | ef:agent/rdkit_post_consensus | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v16 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v17 |
| ef:activity/change/20260820T1812399309960000/288422 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v17 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v18 |
| ef:activity/change/20260820T1812399309960000/307611 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v18 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v19 |
| ef:activity/change/20260820T1812399309960000/389353 | properties | ef:agent/normalise_property_values | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v19 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v20 |
| ef:activity/change/20260820T1812399309960000/396464 | types | ef:agent/link_flows_to_their_substance | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v20 | ef:flow/1940b3b3-47e8-462a-aa0c-803f70a62843/v21 |