3-methylpentan-3-ol
Everything that changed this flow. Back to the flow
07098d6a-a7bf-4c34-8af0-0441cbfd7d84
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 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 75837' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=3-methylpentan-3-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'77-74-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-90a3867cd7a4c109: {'77-74-7': '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 lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 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=['77-74-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[6493]; selected_pubchem_cids=[6493]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,704 | bootstrap_labels | prefLabel | — | [{"@value":"3-methylpentan-3-ol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 5,705 | bootstrap_labels | name | 3-methylpentan-3-ol | — | Purged legacy name field to enforce prefLabel usage |
| 5,706 | bootstrap_labels | synonyms | ["3-methylpentan-3-ol","3-methyl-3-pentanol","3-pentanol,3-methyl-(8ci,9ci)","3-METHYL-3-PENTANOL","3-Methyl-pentanol-(… | [] | Removed legacy synonyms field in favor of structured labels |
| 30,926 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 30,927 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 215,244 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,669 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,670 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,671 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J69.490H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['77-74-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[6493]; selected_pubchem_cids=[6493]; 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 |
| 249,896 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | rdkit_pre_consensus from 'CCC(C)(CC)O'; added: molecular_mass, monoisotopic_mass |
| 262,141 | consensus_match | altLabel | [] | [{"@value":"1-Ethyl-1-methyl-1-propanol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | group_key=3-methylpentan-3-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=77-74-7; added Common Chemistry CAS names as altLabel: 1-Ethyl-1-methyl-1-propanol, 2-Ethyl-2-butanol, 3-Hydroxy-3-methylpentane, 3-Methyl-3-pentanol, 3-Methyl-3-pentyl alcohol, 3-Pentanol, 3-methyl-, NSC 75837; object_uuid=fo-90a3867cd7a4c109 |
| 262,142 | consensus_match | cas_match_labels | — | {"77-74-7":"exactMatch"} | group_key=3-methylpentan-3-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'77-74-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-90a3867cd7a4c109: {'77-74-7': 'exactMatch'} |
| 275,031 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-methylpentan-3-ol' |
| 281,522 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | rdkit_post_consensus from 'CCC(C)(O)CC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,417 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Ethyl-1-methyl-1-propanol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | [{"@value":"1-Ethyl-1-methyl-1-propanol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | Removed 1 catalogue altLabel value(s): 'NSC 75837' (registry code) |
| 296,502 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/07098d6a-a7bf-… | associations resolved on the elementary layer |
| 389,341 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H14O"],"… | typed the way the ontology types it |
| 396,443 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260821T1302361922970000/5704 | prefLabel | ef:agent/bootstrap_labels | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v0 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v1 |
| ef:activity/change/20260821T1302361922970000/5705 | name | ef:agent/bootstrap_labels | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v1 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v2 |
| ef:activity/change/20260821T1302361922970000/5706 | synonyms | ef:agent/bootstrap_labels | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v2 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v3 |
| ef:activity/change/20260821T1302361922970000/30926 | context | ef:agent/default_context_mapping | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v3 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v4 |
| ef:activity/change/20260821T1302361922970000/30927 | context_iri | ef:agent/default_context_mapping | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v4 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v5 |
| ef:activity/change/20260821T1302361922970000/215244 | unit_iri | ef:agent/unit_normalization | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v5 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v6 |
| ef:activity/change/20260821T1302361922970000/232669 | properties | ef:agent/enrich_references | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v6 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v7 |
| ef:activity/change/20260821T1302361922970000/232670 | skos_definition | ef:agent/enrich_references | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v7 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v8 |
| ef:activity/change/20260821T1302361922970000/232671 | references | ef:agent/enrich_references | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v8 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v9 |
| ef:activity/change/20260821T1302361922970000/249896 | properties | ef:agent/rdkit_pre_consensus | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v9 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v10 |
| ef:activity/change/20260821T1302361922970000/262141 | altLabel | ef:agent/consensus_match | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v10 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v11 |
| ef:activity/change/20260821T1302361922970000/262142 | cas_match_labels | ef:agent/consensus_match | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v11 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v12 |
| ef:activity/change/20260821T1302361922970000/275031 | properties | ef:agent/opsin_iupac | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v12 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v13 |
| ef:activity/change/20260821T1302361922970000/281522 | properties | ef:agent/rdkit_post_consensus | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v13 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v14 |
| ef:activity/change/20260821T1302361922970000/288417 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v14 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v15 |
| ef:activity/change/20260821T1302361922970000/296502 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v15 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v16 |
| ef:activity/change/20260821T1302361922970000/389341 | properties | ef:agent/normalise_property_values | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v16 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v17 |
| ef:activity/change/20260821T1302361922970000/396443 | types | ef:agent/link_flows_to_their_substance | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v17 | ef:flow/07098d6a-a7bf-4c34-8af0-0441cbfd7d84/v18 |