Perhydroazocine
Everything that changed this flow. Back to the flow
eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f
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 | 2 | chebi_altlabels, consensus_match | group_key=perhydroazocine||dimension=Environmental > media=Ground > geography=Agricultural; cas=1121-92-2; added Common Chemistry CAS names as altLabel: 1-Azacyclooctane, Azocan, Azocine, octahydro-; object_uuid=fo-8812609cdcbf47de |
| 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=perhydroazocine||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1121-92-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8812609cdcbf47de: {'1121-92-2': '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 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=['1121-92-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_38792']; candidate_pubchem_cids=[14276, 158657604]; selected_pubchem_cids=[14276]; 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 |
|---|---|---|---|---|---|
| 14,940 | bootstrap_labels | prefLabel | — | [{"@value":"perhydroazocine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Bootstrapped prefLabel from legacy name field |
| 14,941 | bootstrap_labels | name | perhydroazocine | — | Purged legacy name field to enforce prefLabel usage |
| 14,942 | bootstrap_labels | synonyms | ["organic","perhydroazocine","perhydroazocineothernamesazacyclooctane"] | [] | Removed legacy synonyms field in favor of structured labels |
| 190,522 | 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 |
| 190,523 | 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 |
| 218,261 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,537 | normalize_name_case | prefLabel | [{"@value":"perhydroazocine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | [{"@value":"Perhydroazocine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,303 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 241,304 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,305 | enrich_references | references | [] | [{"@id":"beilstein:102615","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['1121-92-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_38792']; candidate_pubchem_cids=[14276, 158657604]; selected_pubchem_cids=[14276]; 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 |
| 252,386 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | rdkit_pre_consensus from 'C1CCCNCCC1'; added: monoisotopic_mass |
| 256,372 | chebi_altlabels | altLabel | [] | [{"@value":"azacyclooctane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 270,524 | consensus_match | altLabel | [{"@value":"azacyclooctane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | [{"@value":"azacyclooctane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | group_key=perhydroazocine||dimension=Environmental > media=Ground > geography=Agricultural; cas=1121-92-2; added Common Chemistry CAS names as altLabel: 1-Azacyclooctane, Azocan, Azocine, octahydro-; object_uuid=fo-8812609cdcbf47de |
| 270,525 | consensus_match | cas_match_labels | — | {"1121-92-2":"exactMatch"} | group_key=perhydroazocine||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1121-92-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8812609cdcbf47de: {'1121-92-2': 'exactMatch'} |
| 277,580 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Perhydroazocine' |
| 284,276 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | rdkit_post_consensus from 'C1CCCNCCC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 376,291 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/eb45f1f2-b4f6-… | associations resolved on the elementary layer |
| 391,934 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15N"],"… | typed the way the ontology types it |
| 400,186 | 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/20260822T0600486828500000/14940 | prefLabel | ef:agent/bootstrap_labels | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v0 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v1 |
| ef:activity/change/20260822T0600486828500000/14941 | name | ef:agent/bootstrap_labels | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v1 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v2 |
| ef:activity/change/20260822T0600486828500000/14942 | synonyms | ef:agent/bootstrap_labels | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v2 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v3 |
| ef:activity/change/20260822T0600486828500000/190522 | context | ef:agent/default_context_mapping | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v3 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v4 |
| ef:activity/change/20260822T0600486828500000/190523 | context_iri | ef:agent/default_context_mapping | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v4 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v5 |
| ef:activity/change/20260822T0600486828500000/218261 | unit_iri | ef:agent/unit_normalization | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v5 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v6 |
| ef:activity/change/20260822T0600486828500000/224537 | prefLabel | ef:agent/normalize_name_case | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v6 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v7 |
| ef:activity/change/20260822T0600486828500000/241303 | properties | ef:agent/enrich_references | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v7 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v8 |
| ef:activity/change/20260822T0600486828500000/241304 | skos_definition | ef:agent/enrich_references | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v8 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v9 |
| ef:activity/change/20260822T0600486828500000/241305 | references | ef:agent/enrich_references | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v9 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v10 |
| ef:activity/change/20260822T0600486828500000/252386 | properties | ef:agent/rdkit_pre_consensus | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v10 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v11 |
| ef:activity/change/20260822T0600486828500000/256372 | altLabel | ef:agent/chebi_altlabels | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v11 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v12 |
| ef:activity/change/20260822T0600486828500000/270524 | altLabel | ef:agent/consensus_match | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v12 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v13 |
| ef:activity/change/20260822T0600486828500000/270525 | cas_match_labels | ef:agent/consensus_match | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v13 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v14 |
| ef:activity/change/20260822T0600486828500000/277580 | properties | ef:agent/opsin_iupac | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v14 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v15 |
| ef:activity/change/20260822T0600486828500000/284276 | properties | ef:agent/rdkit_post_consensus | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v15 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v16 |
| ef:activity/change/20260822T0600486828500000/376291 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v16 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v17 |
| ef:activity/change/20260822T0600486828500000/391934 | properties | ef:agent/normalise_property_values | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v17 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v18 |
| ef:activity/change/20260822T0600486828500000/400186 | types | ef:agent/link_flows_to_their_substance | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v18 | ef:flow/eb45f1f2-b4f6-4a2e-9911-f132f9c2a53f/v19 |