Calcium Thiosulfate
Everything that changed this flow. Back to the flow
e5303ad2-9382-4d54-b3a3-9258215c66b0
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=calciumthiosulfate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'10124-41-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ffdf0985125993c4: {'10124-41-1': '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 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['10124-41-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[24964, 131864669]; selected_pubchem_cids=[131864669]; 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 |
|---|---|---|---|---|---|
| 14,900 | bootstrap_labels | prefLabel | — | [{"@value":"calcium thiosulfate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 14,901 | bootstrap_labels | name | calcium thiosulfate | — | Purged legacy name field to enforce prefLabel usage |
| 14,902 | bootstrap_labels | synonyms | ["inorganic","calciumthiosulphate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 187,034 | 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 |
| 187,035 | 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 |
| 218,249 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,530 | normalize_name_case | prefLabel | [{"@value":"calcium thiosulfate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | [{"@value":"Calcium Thiosulfate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,268 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,269 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,270 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=10124-41-1","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['10124-41-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[24964, 131864669]; selected_pubchem_cids=[131864669]; 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 |
| 252,375 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | rdkit_pre_consensus from 'OS(=O)(=S)O.[Ca]'; added: molecular_formula, molecular_mass, monoisotopic_mass |
| 264,822 | consensus_match | altLabel | [] | [{"@value":"BSP Captor","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"cons… | group_key=calciumthiosulfate||dimension=Environmental > media=Ground > geography=Agricultural; cas=10124-41-1; added Common Chemistry CAS names as altLabel: BSP Captor, Calcium hyposulfite, Calcium thiosulfate (Ca(S<sub>2</sub>O<sub>3</sub>)), Thiosulfuric acid (H<sub>2</sub>S<sub>2</sub>O<sub>3</sub>), calcium salt (1:1), Thiosulfuric acid, calcium salt (1:1); object_uuid=fo-ffdf0985125993c4 |
| 264,823 | consensus_match | cas_match_labels | — | {"10124-41-1":"exactMatch"} | group_key=calciumthiosulfate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'10124-41-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ffdf0985125993c4: {'10124-41-1': 'exactMatch'} |
| 277,569 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Calcium Thiosulfate' |
| 284,265 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | rdkit_post_consensus from 'O=S([O-])([O-])=S.[Ca+2]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 287,053 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CaH2O3S2",… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 292,791 | dedupe_altlabels | altLabel | [{"@value":"BSP Captor","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"cons… | [{"@value":"BSP Captor","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"cons… | Deduplicated altLabel values and removed entries matching prefLabel |
| 374,545 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e5303ad2-9382-… | associations resolved on the elementary layer |
| 400,172 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1554374006150000/14900 | prefLabel | ef:agent/bootstrap_labels | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v0 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v1 |
| ef:activity/change/20260821T1554374006150000/14901 | name | ef:agent/bootstrap_labels | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v1 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v2 |
| ef:activity/change/20260821T1554374006150000/14902 | synonyms | ef:agent/bootstrap_labels | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v2 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v3 |
| ef:activity/change/20260821T1554374006150000/187034 | context | ef:agent/default_context_mapping | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v3 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v4 |
| ef:activity/change/20260821T1554374006150000/187035 | context_iri | ef:agent/default_context_mapping | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v4 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v5 |
| ef:activity/change/20260821T1554374006150000/218249 | unit_iri | ef:agent/unit_normalization | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v5 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v6 |
| ef:activity/change/20260821T1554374006150000/224530 | prefLabel | ef:agent/normalize_name_case | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v6 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v7 |
| ef:activity/change/20260821T1554374006150000/241268 | properties | ef:agent/enrich_references | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v7 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v8 |
| ef:activity/change/20260821T1554374006150000/241269 | skos_definition | ef:agent/enrich_references | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v8 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v9 |
| ef:activity/change/20260821T1554374006150000/241270 | references | ef:agent/enrich_references | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v9 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v10 |
| ef:activity/change/20260821T1554374006150000/252375 | properties | ef:agent/rdkit_pre_consensus | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v10 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v11 |
| ef:activity/change/20260821T1554374006150000/264822 | altLabel | ef:agent/consensus_match | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v11 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v12 |
| ef:activity/change/20260821T1554374006150000/264823 | cas_match_labels | ef:agent/consensus_match | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v12 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v13 |
| ef:activity/change/20260821T1554374006150000/277569 | properties | ef:agent/opsin_iupac | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v13 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v14 |
| ef:activity/change/20260821T1554374006150000/284265 | properties | ef:agent/rdkit_post_consensus | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v14 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v15 |
| ef:activity/change/20260821T1554374006150000/287053 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v15 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v16 |
| ef:activity/change/20260821T1554374006150000/292791 | altLabel | ef:agent/dedupe_altlabels | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v16 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v17 |
| ef:activity/change/20260821T1554374006150000/374545 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v17 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v18 |
| ef:activity/change/20260821T1554374006150000/400172 | types | ef:agent/link_flows_to_their_substance | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v18 | ef:flow/e5303ad2-9382-4d54-b3a3-9258215c66b0/v19 |