Propylamine
Everything that changed this flow. Back to the flow
9335cd9a-1d0e-448d-9c26-abd3bdda2673
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 7490' (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=propylamine||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'107-10-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9907ad6e1fe088c2: {'107-10-8': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['107-10-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39870']; candidate_pubchem_cids=[7852, 5058359]; selected_pubchem_cids=[7852]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 18,581 | bootstrap_labels | prefLabel | — | [{"@value":"propylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | Bootstrapped prefLabel from legacy name field |
| 18,582 | bootstrap_labels | name | propylamine | — | Purged legacy name field to enforce prefLabel usage |
| 18,583 | bootstrap_labels | synonyms | ["(C10-C16) Alkylalkoxypropyleneamine","(C10-C16)Alkylalkoxypropyleneamine","(C12-C18) Alkylalkoxypropyleneamine","(C12… | [] | Removed legacy synonyms field in favor of structured labels |
| 137,334 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 137,335 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 219,411 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,325 | normalize_name_case | prefLabel | [{"@value":"propylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | [{"@value":"Propylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 244,530 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 244,531 | enrich_references | skos_definition | — | [{"@value":"A member of the class of alkylamines that is propane substituted by an amino group at C-1.","@language":"en… | Merged ChEBI/PubChem definitions into skos:definition |
| 244,532 | enrich_references | references | [] | [{"@id":"beilstein:1098243","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['107-10-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39870']; candidate_pubchem_cids=[7852, 5058359]; selected_pubchem_cids=[7852]; 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 |
| 253,319 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | rdkit_pre_consensus from 'CCCN'; added: monoisotopic_mass |
| 256,819 | chebi_altlabels | altLabel | [] | [{"@value":"1-Propylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 271,115 | consensus_match | altLabel | [{"@value":"1-Propylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | [{"@value":"1-Propylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | group_key=propylamine||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=107-10-8; added Common Chemistry CAS names as altLabel: (<em>n</em>-Propan-1-yl)amine, 3-Aminopropane, Monopropylamine, NSC 7490, Propan-1-ylamine; object_uuid=fo-9907ad6e1fe088c2 |
| 271,116 | consensus_match | cas_match_labels | — | {"107-10-8":"exactMatch"} | group_key=propylamine||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'107-10-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9907ad6e1fe088c2: {'107-10-8': 'exactMatch'} |
| 278,530 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Propylamine' |
| 285,298 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | rdkit_post_consensus from 'CCCN'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,995 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Propylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | [{"@value":"1-Propylamine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"c… | Removed 1 catalogue altLabel value(s): 'NSC 7490' (registry code) |
| 349,667 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9335cd9a-1d0e-… | associations resolved on the elementary layer |
| 392,898 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9N"],"a… | typed the way the ontology types it |
| 401,584 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T1554374006150000/18581 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v0 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v1 |
| ef:activity/change/20260821T1554374006150000/18582 | name | ef:agent/bootstrap_labels | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v1 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v2 |
| ef:activity/change/20260821T1554374006150000/18583 | synonyms | ef:agent/bootstrap_labels | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v2 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v3 |
| ef:activity/change/20260821T1554374006150000/137334 | context | ef:agent/default_context_mapping | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v3 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v4 |
| ef:activity/change/20260821T1554374006150000/137335 | context_iri | ef:agent/default_context_mapping | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v4 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v5 |
| ef:activity/change/20260821T1554374006150000/219411 | unit_iri | ef:agent/unit_normalization | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v5 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v6 |
| ef:activity/change/20260821T1554374006150000/225325 | prefLabel | ef:agent/normalize_name_case | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v6 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v7 |
| ef:activity/change/20260821T1554374006150000/244530 | properties | ef:agent/enrich_references | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v7 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v8 |
| ef:activity/change/20260821T1554374006150000/244531 | skos_definition | ef:agent/enrich_references | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v8 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v9 |
| ef:activity/change/20260821T1554374006150000/244532 | references | ef:agent/enrich_references | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v9 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v10 |
| ef:activity/change/20260821T1554374006150000/253319 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v10 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v11 |
| ef:activity/change/20260821T1554374006150000/256819 | altLabel | ef:agent/chebi_altlabels | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v11 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v12 |
| ef:activity/change/20260821T1554374006150000/271115 | altLabel | ef:agent/consensus_match | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v12 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v13 |
| ef:activity/change/20260821T1554374006150000/271116 | cas_match_labels | ef:agent/consensus_match | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v13 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v14 |
| ef:activity/change/20260821T1554374006150000/278530 | properties | ef:agent/opsin_iupac | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v14 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v15 |
| ef:activity/change/20260821T1554374006150000/285298 | properties | ef:agent/rdkit_post_consensus | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v15 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v16 |
| ef:activity/change/20260821T1554374006150000/290995 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v16 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v17 |
| ef:activity/change/20260821T1554374006150000/349667 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v17 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v18 |
| ef:activity/change/20260821T1554374006150000/392898 | properties | ef:agent/normalise_property_values | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v18 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v19 |
| ef:activity/change/20260821T1554374006150000/401584 | types | ef:agent/link_flows_to_their_substance | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v19 | ef:flow/9335cd9a-1d0e-448d-9c26-abd3bdda2673/v20 |