2,2'-(octadec-9-enylimino)bisethanol
Everything that changed this flow. Back to the flow
32abe314-7cdf-40e8-ba97-605d1d985abc
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 | 1 | consensus_match | group_key=2,2'-(octadec-9-enylimino)bisethanol||dimension=Environmental > media=Air > strata=Unknown; cas=25307-17-9; added Common Chemistry CAS names as altLabel: 2,2′-(9-Octadecen-1-ylimino)bis[ethanol], Ethanol, 2,2′-(9-octadecen-1-ylimino)bis-, Ethanol, 2,2′-(9-octadecenylimino)bis-, Ethanol, 2,2′-(9-octadecenylimino)di-; object_uuid=fo-acf72da262ecd987 |
| cas_match_labels | 1 | consensus_match | group_key=2,2'-(octadec-9-enylimino)bisethanol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'25307-17-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-acf72da262ecd987: {'25307-17-9': '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 soil > Emissions to agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 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=['25307-17-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[61580, 6537107, 53431059, 86739701, 87073333]; selected_pubchem_cids=[61580]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 638 | bootstrap_labels | prefLabel | — | [{"@value":"2,2'-(octadec-9-enylimino)bisethanol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | Bootstrapped prefLabel from legacy name field |
| 639 | bootstrap_labels | name | 2,2'-(octadec-9-enylimino)bisethanol | — | Purged legacy name field to enforce prefLabel usage |
| 640 | bootstrap_labels | synonyms | ["organic","2,2'","-(octadec-9-enylimino)bisethanol","bis-(2-hydroxyethyl)oleylamine","cecajel","di-n-(2-hydroxyeth… | [] | Removed legacy synonyms field in favor of structured labels |
| 70,110 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 70,111 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 213,553 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 227,781 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,782 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,783 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.042.538","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['25307-17-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[61580, 6537107, 53431059, 86739701, 87073333]; selected_pubchem_cids=[61580]; 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 |
| 248,486 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | rdkit_pre_consensus from 'CCCCCCCCC=CCCCCCCCCN(CCO)CCO'; added: molecular_mass, monoisotopic_mass |
| 259,463 | consensus_match | altLabel | [] | [{"@value":"2,2′-(9-Octadecen-1-ylimino)bis[ethanol]","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match… | group_key=2,2'-(octadec-9-enylimino)bisethanol||dimension=Environmental > media=Air > strata=Unknown; cas=25307-17-9; added Common Chemistry CAS names as altLabel: 2,2′-(9-Octadecen-1-ylimino)bis[ethanol], Ethanol, 2,2′-(9-octadecen-1-ylimino)bis-, Ethanol, 2,2′-(9-octadecenylimino)bis-, Ethanol, 2,2′-(9-octadecenylimino)di-; object_uuid=fo-acf72da262ecd987 |
| 259,464 | consensus_match | cas_match_labels | — | {"25307-17-9":"exactMatch"} | group_key=2,2'-(octadec-9-enylimino)bisethanol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'25307-17-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-acf72da262ecd987: {'25307-17-9': 'exactMatch'} |
| 273,628 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,2'-(octadec-9-enylimino)bisethanol' |
| 279,991 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | rdkit_post_consensus from 'CCCCCCCCC=CCCCCCCCCN(CCO)CCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 316,092 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/32abe314-7cdf-… | associations resolved on the elementary layer |
| 387,904 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H45NO2"… | typed the way the ontology types it |
| 394,440 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260820T1416470405690000/638 | prefLabel | ef:agent/bootstrap_labels | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v0 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v1 |
| ef:activity/change/20260820T1416470405690000/639 | name | ef:agent/bootstrap_labels | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v1 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v2 |
| ef:activity/change/20260820T1416470405690000/640 | synonyms | ef:agent/bootstrap_labels | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v2 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v3 |
| ef:activity/change/20260820T1416470405690000/70110 | context | ef:agent/default_context_mapping | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v3 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v4 |
| ef:activity/change/20260820T1416470405690000/70111 | context_iri | ef:agent/default_context_mapping | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v4 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v5 |
| ef:activity/change/20260820T1416470405690000/213553 | unit_iri | ef:agent/unit_normalization | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v5 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v6 |
| ef:activity/change/20260820T1416470405690000/227781 | properties | ef:agent/enrich_references | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v6 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v7 |
| ef:activity/change/20260820T1416470405690000/227782 | skos_definition | ef:agent/enrich_references | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v7 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v8 |
| ef:activity/change/20260820T1416470405690000/227783 | references | ef:agent/enrich_references | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v8 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v9 |
| ef:activity/change/20260820T1416470405690000/248486 | properties | ef:agent/rdkit_pre_consensus | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v9 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v10 |
| ef:activity/change/20260820T1416470405690000/259463 | altLabel | ef:agent/consensus_match | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v10 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v11 |
| ef:activity/change/20260820T1416470405690000/259464 | cas_match_labels | ef:agent/consensus_match | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v11 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v12 |
| ef:activity/change/20260820T1416470405690000/273628 | properties | ef:agent/opsin_iupac | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v12 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v13 |
| ef:activity/change/20260820T1416470405690000/279991 | properties | ef:agent/rdkit_post_consensus | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v13 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v14 |
| ef:activity/change/20260820T1416470405690000/316092 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v14 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v15 |
| ef:activity/change/20260820T1416470405690000/387904 | properties | ef:agent/normalise_property_values | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v15 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v16 |
| ef:activity/change/20260820T1416470405690000/394440 | types | ef:agent/link_flows_to_their_substance | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v16 | ef:flow/32abe314-7cdf-40e8-ba97-605d1d985abc/v17 |