1-iodohexadecane
Everything that changed this flow. Back to the flow
f177ad4c-ca11-4f75-bd75-d702af540046
By field
14 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=1-iodohexadecane||dimension=Environmental > media=Water > water_body=Unknown; cas=544-77-4; added Common Chemistry CAS names as altLabel: Cetyl iodide, Hexadecane, 1-iodo-, Hexadecyl iodide; object_uuid=fo-35c143cae13bdca0 |
| cas_match_labels | 1 | consensus_match | group_key=1-iodohexadecane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'544-77-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35c143cae13bdca0: {'544-77-4': '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 |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 208-879-4 from CAS 544-77-4 |
| 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=['544-77-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[11007]; selected_pubchem_cids=[11007]; 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 |
|---|---|---|---|---|---|
| 1,693 | bootstrap_labels | prefLabel | — | [{"@value":"1-iodohexadecane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 1,694 | bootstrap_labels | name | 1-iodohexadecane | — | Purged legacy name field to enforce prefLabel usage |
| 1,695 | bootstrap_labels | synonyms | ["AC1L1WFE","AC1Q2W57","Cetyl iodide","Hexadecane, 1-iodo-","Hexadecyl iodide","I0408","I14-14224","S14-1132","SBB07097… | [] | Removed legacy synonyms field in favor of structured labels |
| 194,014 | 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 |
| 194,015 | 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 |
| 213,903 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,724 | ec_cross_check | ec_numbers | [] | ["208-879-4"] | Resolved from EC-inventory: 208-879-4 from CAS 544-77-4 |
| 228,811 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,812 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,813 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J95.915D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['544-77-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[11007]; selected_pubchem_cids=[11007]; 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 |
| 248,789 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCCI'; added: molecular_mass, monoisotopic_mass |
| 259,178 | consensus_match | altLabel | [] | [{"@value":"Cetyl iodide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"co… | group_key=1-iodohexadecane||dimension=Environmental > media=Water > water_body=Unknown; cas=544-77-4; added Common Chemistry CAS names as altLabel: Cetyl iodide, Hexadecane, 1-iodo-, Hexadecyl iodide; object_uuid=fo-35c143cae13bdca0 |
| 259,179 | consensus_match | cas_match_labels | — | {"544-77-4":"exactMatch"} | group_key=1-iodohexadecane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'544-77-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35c143cae13bdca0: {'544-77-4': 'exactMatch'} |
| 273,907 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-iodohexadecane' |
| 280,300 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | rdkit_post_consensus from 'CCCCCCCCCCCCCCCCI'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 378,032 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f177ad4c-ca11-… | associations resolved on the elementary layer |
| 388,191 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H33I"],… | typed the way the ontology types it |
| 394,823 | 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/20260820T1812399309960000/1693 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v0 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v1 |
| ef:activity/change/20260820T1812399309960000/1694 | name | ef:agent/bootstrap_labels | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v1 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v2 |
| ef:activity/change/20260820T1812399309960000/1695 | synonyms | ef:agent/bootstrap_labels | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v2 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v3 |
| ef:activity/change/20260820T1812399309960000/194014 | context | ef:agent/default_context_mapping | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v3 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v4 |
| ef:activity/change/20260820T1812399309960000/194015 | context_iri | ef:agent/default_context_mapping | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v4 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v5 |
| ef:activity/change/20260820T1812399309960000/213903 | unit_iri | ef:agent/unit_normalization | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v5 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v6 |
| ef:activity/change/20260820T1812399309960000/226724 | ec_numbers | ef:agent/ec_cross_check | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v6 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v7 |
| ef:activity/change/20260820T1812399309960000/228811 | properties | ef:agent/enrich_references | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v7 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v8 |
| ef:activity/change/20260820T1812399309960000/228812 | skos_definition | ef:agent/enrich_references | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v8 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v9 |
| ef:activity/change/20260820T1812399309960000/228813 | references | ef:agent/enrich_references | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v9 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v10 |
| ef:activity/change/20260820T1812399309960000/248789 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v10 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v11 |
| ef:activity/change/20260820T1812399309960000/259178 | altLabel | ef:agent/consensus_match | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v11 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v12 |
| ef:activity/change/20260820T1812399309960000/259179 | cas_match_labels | ef:agent/consensus_match | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v12 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v13 |
| ef:activity/change/20260820T1812399309960000/273907 | properties | ef:agent/opsin_iupac | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v13 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v14 |
| ef:activity/change/20260820T1812399309960000/280300 | properties | ef:agent/rdkit_post_consensus | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v14 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v15 |
| ef:activity/change/20260820T1812399309960000/378032 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v15 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v16 |
| ef:activity/change/20260820T1812399309960000/388191 | properties | ef:agent/normalise_property_values | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v16 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v17 |
| ef:activity/change/20260820T1812399309960000/394823 | types | ef:agent/link_flows_to_their_substance | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v17 | ef:flow/f177ad4c-ca11-4f75-bd75-d702af540046/v18 |