Decan-2-one
Everything that changed this flow. Back to the flow
8c55aade-d1de-4257-828d-25c8e7f670b9
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | chebi_altlabels | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| cas_match_labels | 1 | consensus_match | group_key=decan-2-one||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'693-54-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-07b71ea78c98005c: {'693-54-9': '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 water > Emissions to fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['693-54-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_77929']; candidate_pubchem_cids=[12741]; selected_pubchem_cids=[12741]; 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 |
|---|---|---|---|---|---|
| 17,495 | bootstrap_labels | prefLabel | — | [{"@value":"decan-2-one","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | Bootstrapped prefLabel from legacy name field |
| 17,496 | bootstrap_labels | name | decan-2-one | — | Purged legacy name field to enforce prefLabel usage |
| 17,497 | bootstrap_labels | synonyms | ["2-Decanone","AC1L209A","METHYL OCTYL KETONE","Methyl n-octyl ketone","Octyl methyl ketone","S14-1005","ST51056583"] | [] | Removed legacy synonyms field in favor of structured labels |
| 133,324 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 133,325 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 219,074 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,101 | normalize_name_case | prefLabel | [{"@value":"decan-2-one","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | [{"@value":"Decan-2-one","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"co… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 243,582 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 243,583 | enrich_references | skos_definition | — | [{"@value":"A methyl ketone that is decane in which the methylene hydrogens at position 2 are replaced by an oxo group.… | Merged ChEBI/PubChem definitions into skos:definition |
| 243,584 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J79.790A","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['693-54-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_77929']; candidate_pubchem_cids=[12741]; selected_pubchem_cids=[12741]; 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 |
| 253,044 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | rdkit_pre_consensus from 'CCCCCCCCC(=O)C'; added: monoisotopic_mass |
| 256,681 | chebi_altlabels | altLabel | [] | [{"@value":"2-Decanone","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"cons… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 265,557 | consensus_match | cas_match_labels | — | {"693-54-9":"exactMatch"} | group_key=decan-2-one||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'693-54-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-07b71ea78c98005c: {'693-54-9': 'exactMatch'} |
| 278,246 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Decan-2-one' |
| 284,993 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | rdkit_post_consensus from 'CCCCCCCCC(C)=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 347,657 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8c55aade-d1de-… | associations resolved on the elementary layer |
| 392,602 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O"],… | typed the way the ontology types it |
| 401,156 | 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/20260821T1554374006150000/17495 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v0 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v1 |
| ef:activity/change/20260821T1554374006150000/17496 | name | ef:agent/bootstrap_labels | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v1 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v2 |
| ef:activity/change/20260821T1554374006150000/17497 | synonyms | ef:agent/bootstrap_labels | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v2 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v3 |
| ef:activity/change/20260821T1554374006150000/133324 | context | ef:agent/default_context_mapping | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v3 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v4 |
| ef:activity/change/20260821T1554374006150000/133325 | context_iri | ef:agent/default_context_mapping | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v4 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v5 |
| ef:activity/change/20260821T1554374006150000/219074 | unit_iri | ef:agent/unit_normalization | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v5 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v6 |
| ef:activity/change/20260821T1554374006150000/225101 | prefLabel | ef:agent/normalize_name_case | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v6 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v7 |
| ef:activity/change/20260821T1554374006150000/243582 | properties | ef:agent/enrich_references | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v7 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v8 |
| ef:activity/change/20260821T1554374006150000/243583 | skos_definition | ef:agent/enrich_references | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v8 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v9 |
| ef:activity/change/20260821T1554374006150000/243584 | references | ef:agent/enrich_references | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v9 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v10 |
| ef:activity/change/20260821T1554374006150000/253044 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v10 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v11 |
| ef:activity/change/20260821T1554374006150000/256681 | altLabel | ef:agent/chebi_altlabels | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v11 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v12 |
| ef:activity/change/20260821T1554374006150000/265557 | cas_match_labels | ef:agent/consensus_match | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v12 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v13 |
| ef:activity/change/20260821T1554374006150000/278246 | properties | ef:agent/opsin_iupac | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v13 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v14 |
| ef:activity/change/20260821T1554374006150000/284993 | properties | ef:agent/rdkit_post_consensus | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v14 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v15 |
| ef:activity/change/20260821T1554374006150000/347657 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v15 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v16 |
| ef:activity/change/20260821T1554374006150000/392602 | properties | ef:agent/normalise_property_values | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v16 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v17 |
| ef:activity/change/20260821T1554374006150000/401156 | types | ef:agent/link_flows_to_their_substance | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v17 | ef:flow/8c55aade-d1de-4257-828d-25c8e7f670b9/v18 |