(2rs,4sr)-2-methyl-4-propyl-1,3-oxathiane
Everything that changed this flow. Back to the flow
ca0cf5e8-5067-4aa7-b962-bd237b2891ca
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=(2rs,4sr)-2-methyl-4-propyl-1,3-oxathiane||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'59323-76-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-64bd430da786a0cb: {'59323-76-1': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 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=['59323-76-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[101010, 6931725, 6931728, 137332601]; selected_pubchem_cids=[101010, 6931725, 6931728, 137332601]; 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 |
|---|---|---|---|---|---|
| 21,363 | bootstrap_labels | prefLabel | — | [{"@value":"(2rs,4sr)-2-methyl-4-propyl-1,3-oxathiane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labe… | Bootstrapped prefLabel from legacy name field |
| 21,364 | bootstrap_labels | name | (2rs,4sr)-2-methyl-4-propyl-1,3-oxathiane | — | Purged legacy name field to enforce prefLabel usage |
| 21,365 | bootstrap_labels | synonyms | ["organic","cis-2-methyl-4-propyl-1,3-oxathiane","oxanefab"] | [] | Removed legacy synonyms field in favor of structured labels |
| 169,422 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 169,423 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 220,207 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 246,738 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=4) |
| 246,739 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,740 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J24.392B","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['59323-76-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[101010, 6931725, 6931728, 137332601]; selected_pubchem_cids=[101010, 6931725, 6931728, 137332601]; 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 |
| 253,966 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | rdkit_pre_consensus from 'CCCC1CCOC(S1)C'; added: molecular_mass, monoisotopic_mass |
| 257,666 | consensus_match | altLabel | [] | [{"@value":"(±)-<em>cis</em>-2-Methyl-4-propyl-1,3-oxathiane","@language":"en","source":{"prov:wasGeneratedBy":"consens… | group_key=(2rs,4sr)-2-methyl-4-propyl-1,3-oxathiane||dimension=Environmental > media=Air > indoor=Unknown; cas=59323-76-1; added Common Chemistry CAS names as altLabel: (±)-<em>cis</em>-2-Methyl-4-propyl-1,3-oxathiane, 1,3-Oxathiane, 2-methyl-4-propyl-, (2<em>R</em>,4<em>S</em>)-<em>rel</em>-, 1,3-Oxathiane, 2-methyl-4-propyl-, <em>cis</em>-, <em>cis</em>-2-Methyl-4-propyl-1,3-oxathiane, <em>rel</em>-(2<em>R</em>,4<em>S</em>)-2-Methyl-4-propyl-1,3-oxathiane; object_uuid=fo-64bd430da786a0cb |
| 257,667 | consensus_match | cas_match_labels | — | {"59323-76-1":"exactMatch"} | group_key=(2rs,4sr)-2-methyl-4-propyl-1,3-oxathiane||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'59323-76-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-64bd430da786a0cb: {'59323-76-1': 'exactMatch'} |
| 279,170 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(±)-cis-2-Methyl-4-propyl-1,3-oxathiane' |
| 286,026 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | rdkit_post_consensus from 'CCC[C@H]1CCO[C@@H](C)S1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,224 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 293,147 | dedupe_altlabels | altLabel | [{"@value":"(±)-<em>cis</em>-2-Methyl-4-propyl-1,3-oxathiane","@language":"en","source":{"prov:wasGeneratedBy":"consens… | [{"@value":"(±)-cis-2-Methyl-4-propyl-1,3-oxathiane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | Deduplicated altLabel values and removed entries matching prefLabel |
| 365,757 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/ca0cf5e8-5067-… | associations resolved on the elementary layer |
| 402,601 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 402,602 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O2S2… | 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/20260820T0738569779880000/21363 | prefLabel | ef:agent/bootstrap_labels | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v0 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v1 |
| ef:activity/change/20260820T0738569779880000/21364 | name | ef:agent/bootstrap_labels | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v1 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v2 |
| ef:activity/change/20260820T0738569779880000/21365 | synonyms | ef:agent/bootstrap_labels | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v2 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v3 |
| ef:activity/change/20260820T0738569779880000/169422 | context | ef:agent/default_context_mapping | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v3 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v4 |
| ef:activity/change/20260820T0738569779880000/169423 | context_iri | ef:agent/default_context_mapping | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v4 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v5 |
| ef:activity/change/20260820T0738569779880000/220207 | unit_iri | ef:agent/unit_normalization | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v5 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v6 |
| ef:activity/change/20260820T0738569779880000/246738 | properties | ef:agent/enrich_references | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v6 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v7 |
| ef:activity/change/20260820T0738569779880000/246739 | skos_definition | ef:agent/enrich_references | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v7 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v8 |
| ef:activity/change/20260820T0738569779880000/246740 | references | ef:agent/enrich_references | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v8 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v9 |
| ef:activity/change/20260820T0738569779880000/253966 | properties | ef:agent/rdkit_pre_consensus | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v9 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v10 |
| ef:activity/change/20260820T0738569779880000/257666 | altLabel | ef:agent/consensus_match | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v10 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v11 |
| ef:activity/change/20260820T0738569779880000/257667 | cas_match_labels | ef:agent/consensus_match | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v11 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v12 |
| ef:activity/change/20260820T0738569779880000/279170 | properties | ef:agent/opsin_iupac | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v12 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v13 |
| ef:activity/change/20260820T0738569779880000/286026 | properties | ef:agent/rdkit_post_consensus | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v13 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v14 |
| ef:activity/change/20260820T0738569779880000/287224 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v14 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v15 |
| ef:activity/change/20260820T0738569779880000/293147 | altLabel | ef:agent/dedupe_altlabels | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v15 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v16 |
| ef:activity/change/20260820T0738569779880000/365757 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v16 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v17 |
| ef:activity/change/20260820T0738569779880000/402601 | types | ef:agent/link_flows_to_their_substance | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v17 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v18 |
| ef:activity/change/20260820T0738569779880000/402602 | properties | ef:agent/link_flows_to_their_substance | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v18 | ef:flow/ca0cf5e8-5067-4aa7-b962-bd237b2891ca/v19 |