(r)-1-phenylpropylamine
Everything that changed this flow. Back to the flow
d707e5c1-7791-4b78-bc8c-5da9db004790
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=(r)-1-phenylpropylamine||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['pubchem']; cas_sources={'3082-64-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e1da4bf6dae97cf8: {'3082-64-2': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 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=['3082-64-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[7408, 18054, 84352, 5324978, 6993773]; selected_pubchem_cids=[5324978]; 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 |
|---|---|---|---|---|---|
| 19,522 | bootstrap_labels | prefLabel | — | [{"@value":"(r)-1-phenylpropylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttri… | Bootstrapped prefLabel from legacy name field |
| 19,523 | bootstrap_labels | name | (r)-1-phenylpropylamine | — | Purged legacy name field to enforce prefLabel usage |
| 19,524 | bootstrap_labels | synonyms | ["organic","benzenemethanamine,î±-ethyl-,(î±r)-othernames(r)-(+)-1-phenylpropylamine"] | [] | Removed legacy synonyms field in favor of structured labels |
| 177,144 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 177,145 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 219,696 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 245,323 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 245,324 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 245,325 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J57.047H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['3082-64-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[7408, 18054, 84352, 5324978, 6993773]; selected_pubchem_cids=[5324978]; 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 |
| 253,552 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | rdkit_pre_consensus from 'CCC(C1=CC=CC=C1)N'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 257,887 | consensus_match | altLabel | [] | [{"@value":"(+)-((<em>R</em>)-1-Phenylpropyl)amine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match",… | group_key=(r)-1-phenylpropylamine||dimension=Environmental > media=Water > water_body=Surface water; cas=3082-64-2; added Common Chemistry CAS names as altLabel: (+)-((<em>R</em>)-1-Phenylpropyl)amine, (+)-1-Ethylbenzylamine, (+)-1-Phenylpropylamine, (+)-α-Phenylpropylamine, (1<em>R</em>)-1-Phenylpropan-1-amine, (1<em>R</em>)-1-Phenylpropylamine, (<em>R</em>)-(+)-1-Phenyl-1-propylamine, (<em>R</em>)-(+)-1-Phenylpropylamine, (<em>R</em>)-(+)-α-Phenyl-1-propylamine, (<em>R</em>)-1-Phenyl-1-propanamine, (<em>R</em>)-α-Ethylbenzylamine, (<em>R</em>)-α-Phenylpropylamine, (R)-(+)-α-Ethylbenzylamine, (R)-1-Phenylpropan-1-amine, (R)-1-Phenylpropanamine, (α<em>R</em>)-α-Ethylbenzenemethanamine, Benzenemethanamine, α-ethyl-, (<em>R</em>)-, Benzenemethanamine, α-ethyl-, (α<em>R</em>)-, Benzylamine, α-ethyl-, (<em>R</em>)-(+)-, Benzylamine, α-ethyl-, <em>d</em>-; object_uuid=fo-e1da4bf6dae97cf8 |
| 257,888 | consensus_match | cas_match_labels | — | {"3082-64-2":"exactMatch"} | group_key=(r)-1-phenylpropylamine||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['pubchem']; cas_sources={'3082-64-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e1da4bf6dae97cf8: {'3082-64-2': 'exactMatch'} |
| 278,783 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(r)-1-phenylpropylamine' |
| 285,567 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | rdkit_post_consensus from 'CC[C@@H](N)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 293,063 | dedupe_altlabels | altLabel | [{"@value":"(+)-((<em>R</em>)-1-Phenylpropyl)amine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match",… | [{"@value":"(+)-((R)-1-Phenylpropyl)amine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Deduplicated altLabel values and removed entries matching prefLabel |
| 369,615 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d707e5c1-7791-… | associations resolved on the elementary layer |
| 393,150 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | typed the way the ontology types it |
| 401,947 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 401,948 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | 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/20260820T0738569779880000/19522 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v0 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v1 |
| ef:activity/change/20260820T0738569779880000/19523 | name | ef:agent/bootstrap_labels | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v1 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v2 |
| ef:activity/change/20260820T0738569779880000/19524 | synonyms | ef:agent/bootstrap_labels | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v2 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v3 |
| ef:activity/change/20260820T0738569779880000/177144 | context | ef:agent/default_context_mapping | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v3 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v4 |
| ef:activity/change/20260820T0738569779880000/177145 | context_iri | ef:agent/default_context_mapping | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v4 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v5 |
| ef:activity/change/20260820T0738569779880000/219696 | unit_iri | ef:agent/unit_normalization | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v5 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v6 |
| ef:activity/change/20260820T0738569779880000/245323 | properties | ef:agent/enrich_references | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v6 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v7 |
| ef:activity/change/20260820T0738569779880000/245324 | skos_definition | ef:agent/enrich_references | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v7 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v8 |
| ef:activity/change/20260820T0738569779880000/245325 | references | ef:agent/enrich_references | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v8 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v9 |
| ef:activity/change/20260820T0738569779880000/253552 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v9 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v10 |
| ef:activity/change/20260820T0738569779880000/257887 | altLabel | ef:agent/consensus_match | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v10 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v11 |
| ef:activity/change/20260820T0738569779880000/257888 | cas_match_labels | ef:agent/consensus_match | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v11 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v12 |
| ef:activity/change/20260820T0738569779880000/278783 | properties | ef:agent/opsin_iupac | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v12 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v13 |
| ef:activity/change/20260820T0738569779880000/285567 | properties | ef:agent/rdkit_post_consensus | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v13 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v14 |
| ef:activity/change/20260820T0738569779880000/293063 | altLabel | ef:agent/dedupe_altlabels | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v14 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v15 |
| ef:activity/change/20260820T0738569779880000/369615 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v15 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v16 |
| ef:activity/change/20260820T0738569779880000/393150 | properties | ef:agent/normalise_property_values | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v16 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v17 |
| ef:activity/change/20260820T0738569779880000/401947 | types | ef:agent/link_flows_to_their_substance | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v17 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v18 |
| ef:activity/change/20260820T0738569779880000/401948 | properties | ef:agent/link_flows_to_their_substance | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v18 | ef:flow/d707e5c1-7791-4b78-bc8c-5da9db004790/v19 |