Epichlorohydrin
Everything that changed this flow. Back to the flow
edcbd835-84a9-4202-b30c-db485b6d495a
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'J 006' (grade code), 'NSC 6747' (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=epichlorohydrin||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'106-89-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-219432791f55db28: {'106-89-8': '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 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=['106-89-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_37144']; candidate_pubchem_cids=[7835, 98152, 149428, 5458512, 54366857, 77519558]; selected_pubchem_cids=[7835]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 25,638 | bootstrap_labels | prefLabel | — | [{"@value":"epichlorohydrin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Bootstrapped prefLabel from legacy name field |
| 25,639 | bootstrap_labels | name | epichlorohydrin | — | Purged legacy name field to enforce prefLabel usage |
| 25,640 | bootstrap_labels | synonyms | ["1-chloro-2,3-epoxypropane","epichlorhydrin","epichlorohydrin","oxirane, 2-(chloromethyl)-","(chloromethyl)oxirane","(… | [] | Removed legacy synonyms field in favor of structured labels |
| 191,936 | 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 |
| 191,937 | 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 |
| 221,044 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,626 | normalize_name_case | prefLabel | [{"@value":"epichlorohydrin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | [{"@value":"Epichlorohydrin","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 248,256 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 248,257 | enrich_references | skos_definition | — | [{"@value":"An epoxide that is 1,2-epoxypropene in which one of the methyl hydrogens is substituted by chlorine.","@lan… | Merged ChEBI/PubChem definitions into skos:definition |
| 248,258 | enrich_references | references | [] | [{"@id":"beilstein:79785","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"c… | Added references with provenance; cas_numbers=['106-89-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_37144']; candidate_pubchem_cids=[7835, 98152, 149428, 5458512, 54366857, 77519558]; selected_pubchem_cids=[7835]; 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 |
| 254,370 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | rdkit_pre_consensus from 'C1C(O1)CCl'; added: monoisotopic_mass |
| 257,396 | chebi_altlabels | altLabel | [] | [{"@value":"(RS)-3-chloro-1,2-epoxypropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | Added 9 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 266,697 | consensus_match | altLabel | [{"@value":"(RS)-3-chloro-1,2-epoxypropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"(RS)-3-chloro-1,2-epoxypropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | group_key=epichlorohydrin||dimension=Environmental > media=Air > indoor=Unknown; cas=106-89-8; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-Epichlorhydrin, (Chloromethyl)oxirane, (±)-Epichlorohydrin, 1,2-Epoxy-3-chloropropane, 10: PN: WO2017021334 SEQID: 16 claimed sequence, 3-Chloro-1,2-propylene oxide, 3-Chloropropene-1,2-oxide, 3-Chloropropylene epoxide, 3-Chloropropylene oxide, <em>dl</em>-α-Epichlorohydrin, Chloropropylene oxide, Epicerol, Epoxychloropropane, Glycerol epichlorohydrin, Glycidyl chloride, J 006, MeSH ID: D004811, NSC 6747, Oxirane, (chloromethyl)-, Oxirane, 2-(chloromethyl)-, Propane, 1-chloro-2,3-epoxy-, α-Epichlorohydrin, γ-Chloropropylene oxide; object_uuid=fo-219432791f55db28 |
| 266,698 | consensus_match | cas_match_labels | — | {"106-89-8":"exactMatch"} | group_key=epichlorohydrin||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'106-89-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-219432791f55db28: {'106-89-8': 'exactMatch'} |
| 279,734 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Epichlorohydrin' |
| 286,629 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | rdkit_post_consensus from 'ClCC1CO1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,851 | strip_catalogue_altlabels | altLabel | [{"@value":"(RS)-3-chloro-1,2-epoxypropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"(RS)-3-chloro-1,2-epoxypropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | Removed 2 catalogue altLabel value(s): 'J 006' (grade code), 'NSC 6747' (registry code) |
| 377,000 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/edcbd835-84a9-… | associations resolved on the elementary layer |
| 394,141 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5ClO"],… | typed the way the ontology types it |
| 403,686 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260822T0600486828500000/25638 | prefLabel | ef:agent/bootstrap_labels | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v0 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v1 |
| ef:activity/change/20260822T0600486828500000/25639 | name | ef:agent/bootstrap_labels | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v1 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v2 |
| ef:activity/change/20260822T0600486828500000/25640 | synonyms | ef:agent/bootstrap_labels | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v2 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v3 |
| ef:activity/change/20260822T0600486828500000/191936 | context | ef:agent/default_context_mapping | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v3 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v4 |
| ef:activity/change/20260822T0600486828500000/191937 | context_iri | ef:agent/default_context_mapping | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v4 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v5 |
| ef:activity/change/20260822T0600486828500000/221044 | unit_iri | ef:agent/unit_normalization | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v5 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v6 |
| ef:activity/change/20260822T0600486828500000/226626 | prefLabel | ef:agent/normalize_name_case | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v6 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v7 |
| ef:activity/change/20260822T0600486828500000/248256 | properties | ef:agent/enrich_references | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v7 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v8 |
| ef:activity/change/20260822T0600486828500000/248257 | skos_definition | ef:agent/enrich_references | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v8 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v9 |
| ef:activity/change/20260822T0600486828500000/248258 | references | ef:agent/enrich_references | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v9 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v10 |
| ef:activity/change/20260822T0600486828500000/254370 | properties | ef:agent/rdkit_pre_consensus | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v10 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v11 |
| ef:activity/change/20260822T0600486828500000/257396 | altLabel | ef:agent/chebi_altlabels | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v11 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v12 |
| ef:activity/change/20260822T0600486828500000/266697 | altLabel | ef:agent/consensus_match | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v12 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v13 |
| ef:activity/change/20260822T0600486828500000/266698 | cas_match_labels | ef:agent/consensus_match | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v13 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v14 |
| ef:activity/change/20260822T0600486828500000/279734 | properties | ef:agent/opsin_iupac | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v14 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v15 |
| ef:activity/change/20260822T0600486828500000/286629 | properties | ef:agent/rdkit_post_consensus | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v15 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v16 |
| ef:activity/change/20260822T0600486828500000/291851 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v16 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v17 |
| ef:activity/change/20260822T0600486828500000/377000 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v17 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v18 |
| ef:activity/change/20260822T0600486828500000/394141 | properties | ef:agent/normalise_property_values | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v18 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v19 |
| ef:activity/change/20260822T0600486828500000/403686 | types | ef:agent/link_flows_to_their_substance | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v19 | ef:flow/edcbd835-84a9-4202-b30c-db485b6d495a/v20 |