1-heptanol
Everything that changed this flow. Back to the flow
08a91e70-3ddc-11dd-9167-0050c2490048
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 2 catalogue altLabel value(s): 'FEMA 2548' (grade code), 'NSC 3703' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1-heptanol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'111-70-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-25786fe46e79220e: {'111-70-6': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 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=['111-70-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_43003']; candidate_pubchem_cids=[8129, 78787]; selected_pubchem_cids=[8129]; 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 |
|---|---|---|---|---|---|
| 6,984 | bootstrap_labels | prefLabel | — | [{"@value":"1-heptanol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"con… | Bootstrapped prefLabel from legacy name field |
| 6,985 | bootstrap_labels | name | 1-heptanol | — | Purged legacy name field to enforce prefLabel usage |
| 6,986 | bootstrap_labels | synonyms | ["1 Heptanol","1-Hydroxyheptane","AC1L1QBW","AC1Q7CPB","AKOS000120104","Alcohol C-7","Alcohol, Heptyl","CPD-9057","Enan… | [] | Removed legacy synonyms field in favor of structured labels |
| 32,746 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 32,747 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 215,671 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 233,876 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 233,877 | enrich_references | skos_definition | — | [{"@value":"A primary alcohol that is heptane substituted by a hydroxy group at position 1. It has been isolated from C… | Merged ChEBI/PubChem definitions into skos:definition |
| 233,878 | enrich_references | references | [] | [{"@id":"beilstein:1731686","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['111-70-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_43003']; candidate_pubchem_cids=[8129, 78787]; selected_pubchem_cids=[8129]; 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 |
| 250,248 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | rdkit_pre_consensus from 'CCCCCCCO'; added: monoisotopic_mass |
| 255,248 | chebi_altlabels | altLabel | [] | [{"@value":"1-hydroxy heptane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | Added 15 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 259,159 | consensus_match | altLabel | [{"@value":"1-hydroxy heptane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | [{"@value":"1-hydroxy heptane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | group_key=1-heptanol||dimension=Environmental > media=Air > strata=Unknown; cas=111-70-6; added Common Chemistry CAS names as altLabel: 1-Hydroxyheptane, NSC 3703; object_uuid=fo-25786fe46e79220e |
| 259,160 | consensus_match | cas_match_labels | — | {"111-70-6":"exactMatch"} | group_key=1-heptanol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'111-70-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-25786fe46e79220e: {'111-70-6': 'exactMatch'} |
| 275,388 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-heptanol' |
| 281,899 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | rdkit_post_consensus from 'CCCCCCCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,673 | strip_catalogue_altlabels | altLabel | [{"@value":"1-hydroxy heptane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | [{"@value":"1-hydroxy heptane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo… | Removed 2 catalogue altLabel value(s): 'FEMA 2548' (grade code), 'NSC 3703' (registry code) |
| 297,403 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 389,690 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H16O"],"… | typed the way the ontology types it |
| 396,950 | 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/20260820T1812399309960000/6984 | prefLabel | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v0 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v1 |
| ef:activity/change/20260820T1812399309960000/6985 | name | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v1 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v2 |
| ef:activity/change/20260820T1812399309960000/6986 | synonyms | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v2 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v3 |
| ef:activity/change/20260820T1812399309960000/32746 | context | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v3 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v4 |
| ef:activity/change/20260820T1812399309960000/32747 | context_iri | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v4 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v5 |
| ef:activity/change/20260820T1812399309960000/215671 | unit_iri | ef:agent/unit_normalization | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v5 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v6 |
| ef:activity/change/20260820T1812399309960000/233876 | properties | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v6 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v7 |
| ef:activity/change/20260820T1812399309960000/233877 | skos_definition | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v7 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v8 |
| ef:activity/change/20260820T1812399309960000/233878 | references | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v8 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v9 |
| ef:activity/change/20260820T1812399309960000/250248 | properties | ef:agent/rdkit_pre_consensus | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v9 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v10 |
| ef:activity/change/20260820T1812399309960000/255248 | altLabel | ef:agent/chebi_altlabels | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v10 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v11 |
| ef:activity/change/20260820T1812399309960000/259159 | altLabel | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v11 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v12 |
| ef:activity/change/20260820T1812399309960000/259160 | cas_match_labels | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v12 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v13 |
| ef:activity/change/20260820T1812399309960000/275388 | properties | ef:agent/opsin_iupac | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v13 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v14 |
| ef:activity/change/20260820T1812399309960000/281899 | properties | ef:agent/rdkit_post_consensus | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v14 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v15 |
| ef:activity/change/20260820T1812399309960000/288673 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v15 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v16 |
| ef:activity/change/20260820T1812399309960000/297403 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v16 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v17 |
| ef:activity/change/20260820T1812399309960000/389690 | properties | ef:agent/normalise_property_values | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v17 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v18 |
| ef:activity/change/20260820T1812399309960000/396950 | types | ef:agent/link_flows_to_their_substance | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v18 | ef:flow/08a91e70-3ddc-11dd-9167-0050c2490048/v19 |