1-methylpyrrolidine
Everything that changed this flow. Back to the flow
97ebb0dc-b4ec-4662-abad-0ae0480ebb3e
By field
14 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 65579' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1-methylpyrrolidine||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'120-94-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2f5b32c076077a9b: {'120-94-5': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 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=['120-94-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_234043']; candidate_pubchem_cids=[887, 8454, 6994333]; selected_pubchem_cids=[8454]; 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 |
| roles | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| 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 |
|---|---|---|---|---|---|
| 19,088 | bootstrap_labels | prefLabel | — | [{"@value":"1-methylpyrrolidine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 19,089 | bootstrap_labels | name | 1-methylpyrrolidine | — | Purged legacy name field to enforce prefLabel usage |
| 19,090 | bootstrap_labels | synonyms | ["2-Pyrrolidone, 1-methyl","AC1L1R14","I11-0373","LTBB001596","Methyl pyrrolidone","Methylpyrrolidine","N-METHYL PYRROL… | [] | Removed legacy synonyms field in favor of structured labels |
| 140,048 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 140,049 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 219,567 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 244,956 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 244,957 | enrich_references | skos_definition | — | [{"@value":"A member of the class of pyrrolidines that is pyrrolidine substituted by a methyl group at position 1.","@l… | Merged ChEBI/PubChem definitions into skos:definition |
| 244,958 | enrich_references | references | [] | [{"@id":"agr:IND607173169","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['120-94-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_234043']; candidate_pubchem_cids=[887, 8454, 6994333]; selected_pubchem_cids=[8454]; 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 |
| 253,443 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | rdkit_pre_consensus from 'CN1CCCC1'; added: monoisotopic_mass |
| 256,879 | chebi_altlabels | altLabel | [] | [{"@value":"N-methylpyrrolidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 259,259 | consensus_match | altLabel | [{"@value":"N-methylpyrrolidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | [{"@value":"N-methylpyrrolidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | group_key=1-methylpyrrolidine||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=120-94-5; added Common Chemistry CAS names as altLabel: NSC 65579, Pyrrolidine, 1-methyl-; object_uuid=fo-2f5b32c076077a9b |
| 259,260 | consensus_match | cas_match_labels | — | {"120-94-5":"exactMatch"} | group_key=1-methylpyrrolidine||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'120-94-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2f5b32c076077a9b: {'120-94-5': 'exactMatch'} |
| 278,671 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-methylpyrrolidine' |
| 285,450 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | rdkit_post_consensus from 'CN1CCCC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,114 | strip_catalogue_altlabels | altLabel | [{"@value":"N-methylpyrrolidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | [{"@value":"N-methylpyrrolidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | Removed 1 catalogue altLabel value(s): 'NSC 65579' (registry code) |
| 351,045 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/97ebb0dc-b4ec-… | associations resolved on the elementary layer |
| 393,039 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11N"],"… | typed the way the ontology types it |
| 401,792 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 401,793 | link_flows_to_their_substance | roles | — | [{"@id":"http://purl.obolibrary.org/obo/CHEBI_24852","rdfs:label":"insecticide","http://www.w3.org/2004/02/skos/core#de… | 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/20260820T1416470405690000/19088 | prefLabel | ef:agent/bootstrap_labels | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v0 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v1 |
| ef:activity/change/20260820T1416470405690000/19089 | name | ef:agent/bootstrap_labels | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v1 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v2 |
| ef:activity/change/20260820T1416470405690000/19090 | synonyms | ef:agent/bootstrap_labels | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v2 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v3 |
| ef:activity/change/20260820T1416470405690000/140048 | context | ef:agent/default_context_mapping | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v3 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v4 |
| ef:activity/change/20260820T1416470405690000/140049 | context_iri | ef:agent/default_context_mapping | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v4 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v5 |
| ef:activity/change/20260820T1416470405690000/219567 | unit_iri | ef:agent/unit_normalization | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v5 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v6 |
| ef:activity/change/20260820T1416470405690000/244956 | properties | ef:agent/enrich_references | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v6 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v7 |
| ef:activity/change/20260820T1416470405690000/244957 | skos_definition | ef:agent/enrich_references | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v7 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v8 |
| ef:activity/change/20260820T1416470405690000/244958 | references | ef:agent/enrich_references | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v8 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v9 |
| ef:activity/change/20260820T1416470405690000/253443 | properties | ef:agent/rdkit_pre_consensus | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v9 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v10 |
| ef:activity/change/20260820T1416470405690000/256879 | altLabel | ef:agent/chebi_altlabels | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v10 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v11 |
| ef:activity/change/20260820T1416470405690000/259259 | altLabel | ef:agent/consensus_match | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v11 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v12 |
| ef:activity/change/20260820T1416470405690000/259260 | cas_match_labels | ef:agent/consensus_match | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v12 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v13 |
| ef:activity/change/20260820T1416470405690000/278671 | properties | ef:agent/opsin_iupac | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v13 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v14 |
| ef:activity/change/20260820T1416470405690000/285450 | properties | ef:agent/rdkit_post_consensus | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v14 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v15 |
| ef:activity/change/20260820T1416470405690000/291114 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v15 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v16 |
| ef:activity/change/20260820T1416470405690000/351045 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v16 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v17 |
| ef:activity/change/20260820T1416470405690000/393039 | properties | ef:agent/normalise_property_values | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v17 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v18 |
| ef:activity/change/20260820T1416470405690000/401792 | types | ef:agent/link_flows_to_their_substance | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v18 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v19 |
| ef:activity/change/20260820T1416470405690000/401793 | roles | ef:agent/link_flows_to_their_substance | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v19 | ef:flow/97ebb0dc-b4ec-4662-abad-0ae0480ebb3e/v20 |