Butyl Xanthate
Everything that changed this flow. Back to the flow
4216ae2c-4668-4d50-8b1b-088f61c5d65b
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 274977' (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=butylxanthate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'110-50-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cbb5af51df110ebe: {'110-50-9': '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 air > Emissions to lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['110-50-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[8055, 3776441]; selected_pubchem_cids=[8055]; 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 |
|---|---|---|---|---|---|
| 16,566 | bootstrap_labels | prefLabel | — | [{"@value":"butyl xanthate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | Bootstrapped prefLabel from legacy name field |
| 16,567 | bootstrap_labels | name | butyl xanthate | — | Purged legacy name field to enforce prefLabel usage |
| 16,568 | bootstrap_labels | synonyms | ["B0747","Butyl potassium xanthate","Butyl potassium xanthogentate","Butylxanthic Acid Potassium Salt","Butylxanthogena… | [] | Removed legacy synonyms field in favor of structured labels |
| 80,700 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 80,701 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 218,776 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,890 | normalize_name_case | prefLabel | [{"@value":"butyl xanthate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | [{"@value":"Butyl Xanthate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,756 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 242,757 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,758 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J661.116H","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['110-50-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[8055, 3776441]; selected_pubchem_cids=[8055]; 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 |
| 252,807 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2"]… | rdkit_pre_consensus from 'CCCCOC(=S)S'; added: molecular_mass, monoisotopic_mass |
| 264,624 | consensus_match | altLabel | [] | [{"@value":"<em>O</em>-Butyl dithiocarbonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | group_key=butylxanthate||dimension=Environmental > media=Air > strata=Unknown; cas=110-50-9; added Common Chemistry CAS names as altLabel: <em>O</em>-Butyl dithiocarbonate, <em>O</em>-Butyl hydrogen carbonodithioate, <em>n</em>-Butyl xanthate, Butylxanthic acid, Carbonic acid, dithio-, <em>O</em>-butyl ester, Carbonodithioic acid, <em>O</em>-butyl ester, NSC 274977; object_uuid=fo-cbb5af51df110ebe |
| 264,625 | consensus_match | cas_match_labels | — | {"110-50-9":"exactMatch"} | group_key=butylxanthate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'110-50-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cbb5af51df110ebe: {'110-50-9': 'exactMatch'} |
| 278,008 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Butyl Xanthate' |
| 284,736 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2",… | rdkit_post_consensus from 'CCCCOC(=S)[S-]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 290,619 | strip_catalogue_altlabels | altLabel | [{"@value":"<em>O</em>-Butyl dithiocarbonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | [{"@value":"O-Butyl dithiocarbonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | Removed 1 catalogue altLabel value(s): 'NSC 274977' (registry code) |
| 321,363 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4216ae2c-4668-… | associations resolved on the elementary layer |
| 392,364 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H10OS2",… | typed the way the ontology types it |
| 400,798 | 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/20260821T1554374006150000/16566 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v0 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v1 |
| ef:activity/change/20260821T1554374006150000/16567 | name | ef:agent/bootstrap_labels | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v1 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v2 |
| ef:activity/change/20260821T1554374006150000/16568 | synonyms | ef:agent/bootstrap_labels | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v2 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v3 |
| ef:activity/change/20260821T1554374006150000/80700 | context | ef:agent/default_context_mapping | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v3 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v4 |
| ef:activity/change/20260821T1554374006150000/80701 | context_iri | ef:agent/default_context_mapping | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v4 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v5 |
| ef:activity/change/20260821T1554374006150000/218776 | unit_iri | ef:agent/unit_normalization | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v5 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v6 |
| ef:activity/change/20260821T1554374006150000/224890 | prefLabel | ef:agent/normalize_name_case | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v6 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v7 |
| ef:activity/change/20260821T1554374006150000/242756 | properties | ef:agent/enrich_references | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v7 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v8 |
| ef:activity/change/20260821T1554374006150000/242757 | skos_definition | ef:agent/enrich_references | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v8 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v9 |
| ef:activity/change/20260821T1554374006150000/242758 | references | ef:agent/enrich_references | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v9 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v10 |
| ef:activity/change/20260821T1554374006150000/252807 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v10 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v11 |
| ef:activity/change/20260821T1554374006150000/264624 | altLabel | ef:agent/consensus_match | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v11 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v12 |
| ef:activity/change/20260821T1554374006150000/264625 | cas_match_labels | ef:agent/consensus_match | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v12 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v13 |
| ef:activity/change/20260821T1554374006150000/278008 | properties | ef:agent/opsin_iupac | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v13 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v14 |
| ef:activity/change/20260821T1554374006150000/284736 | properties | ef:agent/rdkit_post_consensus | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v14 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v15 |
| ef:activity/change/20260821T1554374006150000/290619 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v15 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v16 |
| ef:activity/change/20260821T1554374006150000/321363 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v16 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v17 |
| ef:activity/change/20260821T1554374006150000/392364 | properties | ef:agent/normalise_property_values | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v17 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v18 |
| ef:activity/change/20260821T1554374006150000/400798 | types | ef:agent/link_flows_to_their_substance | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v18 | ef:flow/4216ae2c-4668-4d50-8b1b-088f61c5d65b/v19 |