Ethyl 2-oxocyclohexanecarboxylate
Everything that changed this flow. Back to the flow
6916d68b-8612-48e2-b636-812fd2e795e1
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 18744' (registry code) |
| 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=ethyl2-oxocyclohexanecarboxylate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1655-07-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dc8d2f5e3013d13d: {'1655-07-8': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1655-07-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[95543, 167000, 303691, 7031851, 54695815]; selected_pubchem_cids=[95543]; 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 |
|---|---|---|---|---|---|
| 743 | bootstrap_labels | prefLabel | — | [{"@value":"ethyl 2-oxocyclohexanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Bootstrapped prefLabel from legacy name field |
| 744 | bootstrap_labels | name | ethyl 2-oxocyclohexanecarboxylate | — | Purged legacy name field to enforce prefLabel usage |
| 745 | bootstrap_labels | synonyms | ["organic","ethyl2-oxocyclohexanecarboxylate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 112,404 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 112,405 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 213,582 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,265 | normalize_name_case | prefLabel | [{"@value":"ethyl 2-oxocyclohexanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | [{"@value":"Ethyl 2-oxocyclohexanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,878 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,879 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,880 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J40.677E","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['1655-07-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[95543, 167000, 303691, 7031851, 54695815]; selected_pubchem_cids=[95543]; 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 |
| 248,512 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | rdkit_pre_consensus from 'CCOC(=O)C1CCCCC1=O'; added: molecular_mass, monoisotopic_mass |
| 266,839 | consensus_match | altLabel | [] | [{"@value":"2-(Ethoxycarbonyl)cyclohexanone","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | group_key=ethyl2-oxocyclohexanecarboxylate||dimension=Environmental > media=Water > water_body=Unknown; cas=1655-07-8; added Common Chemistry CAS names as altLabel: 2-(Ethoxycarbonyl)cyclohexanone, 2-Carbethoxycyclohexanone, 2-Carboethoxycyclohexanone, 2-Oxocyclohexanecarboxylic acid ethyl ester, Cyclohexanecarboxylic acid, 2-oxo-, ethyl ester, Ethyl 1-oxo-2-cyclohexanecarboxylate, Ethyl 2-cyclohexanone-1-carboxylate, Ethyl 2-oxo-1-cyclohexanecarboxylate, Ethyl 2-oxocyclohexan-1-carboxylate, Ethyl cyclohexanone-2-carboxylate, NSC 18744; object_uuid=fo-dc8d2f5e3013d13d |
| 266,840 | consensus_match | cas_match_labels | — | {"1655-07-8":"exactMatch"} | group_key=ethyl2-oxocyclohexanecarboxylate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1655-07-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dc8d2f5e3013d13d: {'1655-07-8': 'exactMatch'} |
| 273,639 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Ethyl 2-oxocyclohexanecarboxylate' |
| 280,006 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | rdkit_post_consensus from 'CCOC(=O)C1CCCCC1=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,400 | strip_catalogue_altlabels | altLabel | [{"@value":"2-(Ethoxycarbonyl)cyclohexanone","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | [{"@value":"2-(Ethoxycarbonyl)cyclohexanone","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | Removed 1 catalogue altLabel value(s): 'NSC 18744' (registry code) |
| 337,201 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6916d68b-8612-… | associations resolved on the elementary layer |
| 387,915 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H14O3"],… | typed the way the ontology types it |
| 394,457 | 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/20260822T0600486828500000/743 | prefLabel | ef:agent/bootstrap_labels | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v0 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v1 |
| ef:activity/change/20260822T0600486828500000/744 | name | ef:agent/bootstrap_labels | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v1 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v2 |
| ef:activity/change/20260822T0600486828500000/745 | synonyms | ef:agent/bootstrap_labels | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v2 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v3 |
| ef:activity/change/20260822T0600486828500000/112404 | context | ef:agent/default_context_mapping | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v3 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v4 |
| ef:activity/change/20260822T0600486828500000/112405 | context_iri | ef:agent/default_context_mapping | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v4 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v5 |
| ef:activity/change/20260822T0600486828500000/213582 | unit_iri | ef:agent/unit_normalization | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v5 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v6 |
| ef:activity/change/20260822T0600486828500000/221265 | prefLabel | ef:agent/normalize_name_case | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v6 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v7 |
| ef:activity/change/20260822T0600486828500000/227878 | properties | ef:agent/enrich_references | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v7 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v8 |
| ef:activity/change/20260822T0600486828500000/227879 | skos_definition | ef:agent/enrich_references | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v8 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v9 |
| ef:activity/change/20260822T0600486828500000/227880 | references | ef:agent/enrich_references | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v9 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v10 |
| ef:activity/change/20260822T0600486828500000/248512 | properties | ef:agent/rdkit_pre_consensus | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v10 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v11 |
| ef:activity/change/20260822T0600486828500000/266839 | altLabel | ef:agent/consensus_match | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v11 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v12 |
| ef:activity/change/20260822T0600486828500000/266840 | cas_match_labels | ef:agent/consensus_match | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v12 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v13 |
| ef:activity/change/20260822T0600486828500000/273639 | properties | ef:agent/opsin_iupac | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v13 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v14 |
| ef:activity/change/20260822T0600486828500000/280006 | properties | ef:agent/rdkit_post_consensus | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v14 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v15 |
| ef:activity/change/20260822T0600486828500000/287400 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v15 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v16 |
| ef:activity/change/20260822T0600486828500000/337201 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v16 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v17 |
| ef:activity/change/20260822T0600486828500000/387915 | properties | ef:agent/normalise_property_values | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v17 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v18 |
| ef:activity/change/20260822T0600486828500000/394457 | types | ef:agent/link_flows_to_their_substance | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v18 | ef:flow/6916d68b-8612-48e2-b636-812fd2e795e1/v19 |