Isoamyl acetate
Everything that changed this flow. Back to the flow
d2dcad25-2dd3-44ae-8ece-c458f4a6c583
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| altLabel | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 3 catalogue altLabel value(s): 'NSC 9260' (registry code), 'T 615B' (grade code), 'T 815A' (grade code) |
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=123-92-2; cc_chebi_agreed_name='Isoamyl acetate'; object_uuid=fo-5a051d6b5782b66d |
| cas_match_labels | 1 | consensus_match | group_key=isopentylacetate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'123-92-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5a051d6b5782b66d: {'123-92-2': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['123-92-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_31725']; candidate_pubchem_cids=[31276, 85604279]; selected_pubchem_cids=[31276]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 3,268 | bootstrap_labels | prefLabel | — | [{"@value":"isopentylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 3,269 | bootstrap_labels | name | isopentylacetate | — | Purged legacy name field to enforce prefLabel usage |
| 25,235 | bootstrap_labels | synonyms | ["isopentylacetate","isoamyl acetate","isopentyl acetate","1-butanol, 3-methyl-, acetate","3-methylbutyl acetate","3-me… | [] | Removed legacy synonyms field in favor of structured labels |
| 174,696 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 174,697 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 214,430 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,839 | normalize_name_case | prefLabel | [{"@value":"isopentylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Isopentylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 230,324 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 230,325 | enrich_references | skos_definition | — | [{"@value":"The acetate ester of isoamylol.","@language":"en","provenance":{"prov:wasGeneratedBy":"enrich_references.ch… | Merged ChEBI/PubChem definitions into skos:definition |
| 230,326 | enrich_references | references | [] | [{"@id":"gmelin:101452","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"con… | Added references with provenance; cas_numbers=['123-92-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_31725']; candidate_pubchem_cids=[31276, 85604279]; selected_pubchem_cids=[31276]; 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 |
| 254,760 | chebi_altlabels | altLabel | [] | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | Added 20 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 268,144 | consensus_match | prefLabel | [{"@value":"Isopentylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Isoamyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":… | cas=123-92-2; cc_chebi_agreed_name='Isoamyl acetate'; object_uuid=fo-5a051d6b5782b66d |
| 268,145 | consensus_match | altLabel | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | cas=123-92-2; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-5a051d6b5782b66d |
| 268,146 | consensus_match | altLabel | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | group_key=isopentylacetate||dimension=Environmental > media=Ground > geography=Agricultural; cas=123-92-2; added Common Chemistry CAS names as altLabel: 1-Butanol, 3-methyl-, 1-acetate, 1-Butanol, 3-methyl-, acetate, <em>iso</em>-Amyl acetate, <em>iso</em>-Pentyl acetate, Acetic acid 3-methyl-1-butyl ester, Acetic acid 3-methylbutyl ester, Acetic acid isopentyl ester, Acetic acid, isoamyl ester, Banana oil, Isoamyl alcohol acetate, Isopentyl alcohol, acetate, NSC 9260, Pear oil, T 615B, T 815A; object_uuid=fo-5a051d6b5782b66d |
| 268,147 | consensus_match | cas_match_labels | — | {"123-92-2":"exactMatch"} | group_key=isopentylacetate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'123-92-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5a051d6b5782b66d: {'123-92-2': 'exactMatch'} |
| 274,343 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Isoamyl acetate' |
| 280,777 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | rdkit_post_consensus from 'CC(=O)OCCC(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,905 | strip_catalogue_altlabels | altLabel | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | [{"@value":"3-methyl-1-butanol acetate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | Removed 3 catalogue altLabel value(s): 'NSC 9260' (registry code), 'T 615B' (grade code), 'T 815A' (grade code) |
| 368,372 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d2dcad25-2dd3-… | associations resolved on the elementary layer |
| 388,640 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H14O2"],… | typed the way the ontology types it |
| 395,458 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260822T0600486828500000/3268 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v0 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v1 |
| ef:activity/change/20260822T0600486828500000/3269 | name | ef:agent/bootstrap_labels | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v1 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v2 |
| ef:activity/change/20260822T0600486828500000/25235 | synonyms | ef:agent/bootstrap_labels | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v2 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v3 |
| ef:activity/change/20260822T0600486828500000/174696 | context | ef:agent/default_context_mapping | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v3 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v4 |
| ef:activity/change/20260822T0600486828500000/174697 | context_iri | ef:agent/default_context_mapping | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v4 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v5 |
| ef:activity/change/20260822T0600486828500000/214430 | unit_iri | ef:agent/unit_normalization | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v5 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v6 |
| ef:activity/change/20260822T0600486828500000/221839 | prefLabel | ef:agent/normalize_name_case | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v6 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v7 |
| ef:activity/change/20260822T0600486828500000/230324 | properties | ef:agent/enrich_references | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v7 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v8 |
| ef:activity/change/20260822T0600486828500000/230325 | skos_definition | ef:agent/enrich_references | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v8 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v9 |
| ef:activity/change/20260822T0600486828500000/230326 | references | ef:agent/enrich_references | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v9 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v10 |
| ef:activity/change/20260822T0600486828500000/254760 | altLabel | ef:agent/chebi_altlabels | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v10 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v11 |
| ef:activity/change/20260822T0600486828500000/268144 | prefLabel | ef:agent/consensus_match | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v11 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v12 |
| ef:activity/change/20260822T0600486828500000/268145 | altLabel | ef:agent/consensus_match | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v12 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v13 |
| ef:activity/change/20260822T0600486828500000/268146 | altLabel | ef:agent/consensus_match | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v13 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v14 |
| ef:activity/change/20260822T0600486828500000/268147 | cas_match_labels | ef:agent/consensus_match | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v14 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v15 |
| ef:activity/change/20260822T0600486828500000/274343 | properties | ef:agent/opsin_iupac | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v15 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v16 |
| ef:activity/change/20260822T0600486828500000/280777 | properties | ef:agent/rdkit_post_consensus | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v16 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v17 |
| ef:activity/change/20260822T0600486828500000/287905 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v17 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v18 |
| ef:activity/change/20260822T0600486828500000/368372 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v18 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v19 |
| ef:activity/change/20260822T0600486828500000/388640 | properties | ef:agent/normalise_property_values | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v19 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v20 |
| ef:activity/change/20260822T0600486828500000/395458 | types | ef:agent/link_flows_to_their_substance | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v20 | ef:flow/d2dcad25-2dd3-44ae-8ece-c458f4a6c583/v21 |