Disodium (z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate
Everything that changed this flow. Back to the flow
c777c7d4-6fad-48e6-a5f4-85b727d26177
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| 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=disodium(z)-4-(9-octadecenylamino)-4-oxo-2(or3)-sulphonatobutyrate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'58353-68-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3246a5fb575aea37: {'58353-68-7': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['58353-68-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[94026, 6436712]; selected_pubchem_cids=[94026, 6436712]; 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 |
|---|---|---|---|---|---|
| 12,611 | bootstrap_labels | prefLabel | — | [{"@value":"disodium (z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate","@language":"en","source":{"prov:wasG… | Bootstrapped prefLabel from legacy name field |
| 12,612 | bootstrap_labels | name | disodium (z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate | — | Purged legacy name field to enforce prefLabel usage |
| 12,613 | bootstrap_labels | synonyms | ["organic","disodium(z)-4-(9-octadecenylamino)-4-oxo-2(or3)-sulphonatobutyrate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 167,886 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 167,887 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 217,512 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,020 | normalize_name_case | prefLabel | [{"@value":"disodium (z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate","@language":"en","source":{"prov:wasG… | [{"@value":"Disodium (z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate","@language":"en","source":{"prov:wasG… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,161 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 239,162 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,163 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.055.638","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['58353-68-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[94026, 6436712]; selected_pubchem_cids=[94026, 6436712]; 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 |
| 251,762 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | rdkit_pre_consensus from 'CCCCCCCC/C=C\\CCCCCCCCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]'; added: molecular_mass, monoisotopic_mass |
| 266,323 | consensus_match | altLabel | [] | [{"@value":"Butanoic acid, 4-(9-octadecenylamino)-4-oxosulfo-, disodium salt, (<em>Z</em>)-","@language":"en","source":… | group_key=disodium(z)-4-(9-octadecenylamino)-4-oxo-2(or3)-sulphonatobutyrate||dimension=Environmental > media=Ground > geography=Unknown; cas=58353-68-7; added Common Chemistry CAS names as altLabel: Butanoic acid, 4-(9-octadecenylamino)-4-oxosulfo-, disodium salt, (<em>Z</em>)-, Butanoic acid, 4-[(9<em>Z</em>)-9-octadecen-1-ylamino]-4-oxosulfo-, sodium salt (1:2), Butanoic acid, 4-[(9<em>Z</em>)-9-octadecenylamino]-4-oxosulfo-, disodium salt, Sodium oleylsulfosuccinamate; object_uuid=fo-3246a5fb575aea37 |
| 266,324 | consensus_match | cas_match_labels | — | {"58353-68-7":"exactMatch"} | group_key=disodium(z)-4-(9-octadecenylamino)-4-oxo-2(or3)-sulphonatobutyrate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'58353-68-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3246a5fb575aea37: {'58353-68-7': 'exactMatch'} |
| 276,949 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Butanoic acid, 4-(9-octadecenylamino)-4-oxosulfo-, disodium salt, (Z)-' |
| 283,599 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | rdkit_post_consensus from 'CCCCCCCC/C=C\\CCCCCCCCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,640 | dedupe_altlabels | altLabel | [{"@value":"Butanoic acid, 4-(9-octadecenylamino)-4-oxosulfo-, disodium salt, (<em>Z</em>)-","@language":"en","source":… | [{"@value":"Butanoic acid, 4-(9-octadecenylamino)-4-oxosulfo-, disodium salt, (Z)-","@language":"en","source":{"prov:wa… | Deduplicated altLabel values and removed entries matching prefLabel |
| 364,969 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c777c7d4-6fad-… | associations resolved on the elementary layer |
| 391,306 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | typed the way the ontology types it |
| 399,276 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | the substance's answer, copied onto its flow |
| 399,277 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C22H39NNa2… | 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/20260822T0600486828500000/12611 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v0 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v1 |
| ef:activity/change/20260822T0600486828500000/12612 | name | ef:agent/bootstrap_labels | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v1 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v2 |
| ef:activity/change/20260822T0600486828500000/12613 | synonyms | ef:agent/bootstrap_labels | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v2 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v3 |
| ef:activity/change/20260822T0600486828500000/167886 | context | ef:agent/default_context_mapping | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v3 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v4 |
| ef:activity/change/20260822T0600486828500000/167887 | context_iri | ef:agent/default_context_mapping | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v4 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v5 |
| ef:activity/change/20260822T0600486828500000/217512 | unit_iri | ef:agent/unit_normalization | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v5 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v6 |
| ef:activity/change/20260822T0600486828500000/224020 | prefLabel | ef:agent/normalize_name_case | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v6 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v7 |
| ef:activity/change/20260822T0600486828500000/239161 | properties | ef:agent/enrich_references | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v7 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v8 |
| ef:activity/change/20260822T0600486828500000/239162 | skos_definition | ef:agent/enrich_references | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v8 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v9 |
| ef:activity/change/20260822T0600486828500000/239163 | references | ef:agent/enrich_references | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v9 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v10 |
| ef:activity/change/20260822T0600486828500000/251762 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v10 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v11 |
| ef:activity/change/20260822T0600486828500000/266323 | altLabel | ef:agent/consensus_match | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v11 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v12 |
| ef:activity/change/20260822T0600486828500000/266324 | cas_match_labels | ef:agent/consensus_match | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v12 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v13 |
| ef:activity/change/20260822T0600486828500000/276949 | properties | ef:agent/opsin_iupac | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v13 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v14 |
| ef:activity/change/20260822T0600486828500000/283599 | properties | ef:agent/rdkit_post_consensus | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v14 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v15 |
| ef:activity/change/20260822T0600486828500000/292640 | altLabel | ef:agent/dedupe_altlabels | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v15 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v16 |
| ef:activity/change/20260822T0600486828500000/364969 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v16 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v17 |
| ef:activity/change/20260822T0600486828500000/391306 | properties | ef:agent/normalise_property_values | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v17 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v18 |
| ef:activity/change/20260822T0600486828500000/399276 | types | ef:agent/link_flows_to_their_substance | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v18 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v19 |
| ef:activity/change/20260822T0600486828500000/399277 | properties | ef:agent/link_flows_to_their_substance | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v19 | ef:flow/c777c7d4-6fad-48e6-a5f4-85b727d26177/v20 |