Sodium Prop-2-enesulphonate
Everything that changed this flow. Back to the flow
356fce77-997d-4adf-8043-74a05884a228
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=sodiumprop-2-enesulphonate||dimension=Environmental > media=Water > water_body=Ocean; cas=2495-39-8; added Common Chemistry CAS names as altLabel: 2-Propene-1-sulfonic acid, sodium salt, 2-Propene-1-sulfonic acid, sodium salt (1:1), Allylsulfonic acid, sodium salt, Sodium 1-propene-3-sulfonate, Sodium 2-propene-1-sulfonate, Sodium allylsulfonate; object_uuid=fo-8846cd268e7683ca |
| cas_match_labels | 1 | consensus_match | group_key=sodiumprop-2-enesulphonate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2495-39-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8846cd268e7683ca: {'2495-39-8': '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 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=['2495-39-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[4447605, 22221737, 23690996, 87059513, 176507838]; selected_pubchem_cids=[87059513]; 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 |
|---|---|---|---|---|---|
| 6,142 | bootstrap_labels | prefLabel | — | [{"@value":"sodium prop-2-enesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Bootstrapped prefLabel from legacy name field |
| 6,143 | bootstrap_labels | name | sodium prop-2-enesulphonate | — | Purged legacy name field to enforce prefLabel usage |
| 21,108 | bootstrap_labels | synonyms | ["sodiumprop-2-enesulphonate","2-propene-1-sulfonic acid, sodium salt (1:1)","2-propene-1-sulfonic acid, sodium salt","… | [] | Removed legacy synonyms field in favor of structured labels |
| 72,422 | 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 |
| 72,423 | 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 |
| 215,392 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,512 | normalize_name_case | prefLabel | [{"@value":"sodium prop-2-enesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | [{"@value":"Sodium Prop-2-enesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,087 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6NaO3S"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 233,088 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,089 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=2495-39-8","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['2495-39-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[4447605, 22221737, 23690996, 87059513, 176507838]; selected_pubchem_cids=[87059513]; 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 |
| 250,020 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6NaO3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6NaO3S"… | rdkit_pre_consensus from 'C=CCS(=O)(=O)O.[Na]'; added: molecular_mass, monoisotopic_mass |
| 272,019 | consensus_match | altLabel | [] | [{"@value":"2-Propene-1-sulfonic acid, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match",… | group_key=sodiumprop-2-enesulphonate||dimension=Environmental > media=Water > water_body=Ocean; cas=2495-39-8; added Common Chemistry CAS names as altLabel: 2-Propene-1-sulfonic acid, sodium salt, 2-Propene-1-sulfonic acid, sodium salt (1:1), Allylsulfonic acid, sodium salt, Sodium 1-propene-3-sulfonate, Sodium 2-propene-1-sulfonate, Sodium allylsulfonate; object_uuid=fo-8846cd268e7683ca |
| 272,020 | consensus_match | cas_match_labels | — | {"2495-39-8":"exactMatch"} | group_key=sodiumprop-2-enesulphonate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2495-39-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8846cd268e7683ca: {'2495-39-8': 'exactMatch'} |
| 275,156 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6NaO3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6NaO3S"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Sodium Prop-2-enesulphonate' |
| 281,653 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H6NaO3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5NaO3S"… | rdkit_post_consensus from 'C=CCS(=O)(=O)[O-].[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,852 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5NaO3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H5NaO3S"… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 317,228 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/356fce77-997d-… | associations resolved on the elementary layer |
| 396,623 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1302361922970000/6142 | prefLabel | ef:agent/bootstrap_labels | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v0 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v1 |
| ef:activity/change/20260821T1302361922970000/6143 | name | ef:agent/bootstrap_labels | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v1 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v2 |
| ef:activity/change/20260821T1302361922970000/21108 | synonyms | ef:agent/bootstrap_labels | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v2 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v3 |
| ef:activity/change/20260821T1302361922970000/72422 | context | ef:agent/default_context_mapping | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v3 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v4 |
| ef:activity/change/20260821T1302361922970000/72423 | context_iri | ef:agent/default_context_mapping | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v4 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v5 |
| ef:activity/change/20260821T1302361922970000/215392 | unit_iri | ef:agent/unit_normalization | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v5 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v6 |
| ef:activity/change/20260821T1302361922970000/222512 | prefLabel | ef:agent/normalize_name_case | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v6 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v7 |
| ef:activity/change/20260821T1302361922970000/233087 | properties | ef:agent/enrich_references | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v7 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v8 |
| ef:activity/change/20260821T1302361922970000/233088 | skos_definition | ef:agent/enrich_references | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v8 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v9 |
| ef:activity/change/20260821T1302361922970000/233089 | references | ef:agent/enrich_references | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v9 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v10 |
| ef:activity/change/20260821T1302361922970000/250020 | properties | ef:agent/rdkit_pre_consensus | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v10 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v11 |
| ef:activity/change/20260821T1302361922970000/272019 | altLabel | ef:agent/consensus_match | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v11 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v12 |
| ef:activity/change/20260821T1302361922970000/272020 | cas_match_labels | ef:agent/consensus_match | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v12 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v13 |
| ef:activity/change/20260821T1302361922970000/275156 | properties | ef:agent/opsin_iupac | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v13 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v14 |
| ef:activity/change/20260821T1302361922970000/281653 | properties | ef:agent/rdkit_post_consensus | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v14 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v15 |
| ef:activity/change/20260821T1302361922970000/286852 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v15 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v16 |
| ef:activity/change/20260821T1302361922970000/317228 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v16 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v17 |
| ef:activity/change/20260821T1302361922970000/396623 | types | ef:agent/link_flows_to_their_substance | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v17 | ef:flow/356fce77-997d-4adf-8043-74a05884a228/v18 |