Sodium 2-(dodecanoyloxy)propane-1-sulfonate
Everything that changed this flow. Back to the flow
d660df40-300d-4c1a-83b6-98eb27e6aa3d
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 |
| 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=sodium2-(dodecanoyloxy)propane-1-sulfonate||dimension=Environmental > media=Ground > geography=Agricultural; cas=156572-81-5; added Common Chemistry CAS names as altLabel: Dodecanoic acid, 1-methyl-2-sulfoethyl ester, sodium salt, Dodecanoic acid, 1-methyl-2-sulfoethyl ester, sodium salt (1:1); object_uuid=fo-81d07b84e91615b5 |
| cas_match_labels | 1 | consensus_match | group_key=sodium2-(dodecanoyloxy)propane-1-sulfonate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'156572-81-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-81d07b84e91615b5: {'156572-81-5': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['156572-81-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[71488934]; selected_pubchem_cids=[71488934]; 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 |
|---|---|---|---|---|---|
| 4,420 | bootstrap_labels | prefLabel | — | [{"@value":"sodium 2-(dodecanoyloxy)propane-1-sulfonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | Bootstrapped prefLabel from legacy name field |
| 4,421 | bootstrap_labels | name | sodium 2-(dodecanoyloxy)propane-1-sulfonate | — | Purged legacy name field to enforce prefLabel usage |
| 4,422 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 176,740 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 176,741 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 214,815 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,107 | normalize_name_case | prefLabel | [{"@value":"sodium 2-(dodecanoyloxy)propane-1-sulfonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | [{"@value":"Sodium 2-(dodecanoyloxy)propane-1-sulfonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 231,430 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,431 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,432 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.110.778","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['156572-81-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[71488934]; selected_pubchem_cids=[71488934]; 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 |
| 249,540 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | rdkit_pre_consensus from 'CCCCCCCCCCCC(=O)OC(C)CS(=O)(=O)[O-].[Na+]'; added: molecular_mass, monoisotopic_mass |
| 271,707 | consensus_match | altLabel | [] | [{"@value":"Dodecanoic acid, 1-methyl-2-sulfoethyl ester, sodium salt","@language":"en","source":{"prov:wasGeneratedBy"… | group_key=sodium2-(dodecanoyloxy)propane-1-sulfonate||dimension=Environmental > media=Ground > geography=Agricultural; cas=156572-81-5; added Common Chemistry CAS names as altLabel: Dodecanoic acid, 1-methyl-2-sulfoethyl ester, sodium salt, Dodecanoic acid, 1-methyl-2-sulfoethyl ester, sodium salt (1:1); object_uuid=fo-81d07b84e91615b5 |
| 271,708 | consensus_match | cas_match_labels | — | {"156572-81-5":"exactMatch"} | group_key=sodium2-(dodecanoyloxy)propane-1-sulfonate||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'156572-81-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-81d07b84e91615b5: {'156572-81-5': 'exactMatch'} |
| 274,671 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Sodium 2-(dodecanoyloxy)propane-1-sulfonate' |
| 281,130 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | rdkit_post_consensus from 'CCCCCCCCCCCC(=O)OC(C)CS(=O)(=O)[O-].[Na+]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 369,393 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d660df40-300d-… | associations resolved on the elementary layer |
| 388,978 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H29NaO5… | typed the way the ontology types it |
| 395,938 | 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/20260821T1554374006150000/4420 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v0 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v1 |
| ef:activity/change/20260821T1554374006150000/4421 | name | ef:agent/bootstrap_labels | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v1 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v2 |
| ef:activity/change/20260821T1554374006150000/4422 | synonyms | ef:agent/bootstrap_labels | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v2 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v3 |
| ef:activity/change/20260821T1554374006150000/176740 | context | ef:agent/default_context_mapping | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v3 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v4 |
| ef:activity/change/20260821T1554374006150000/176741 | context_iri | ef:agent/default_context_mapping | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v4 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v5 |
| ef:activity/change/20260821T1554374006150000/214815 | unit_iri | ef:agent/unit_normalization | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v5 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v6 |
| ef:activity/change/20260821T1554374006150000/222107 | prefLabel | ef:agent/normalize_name_case | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v6 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v7 |
| ef:activity/change/20260821T1554374006150000/231430 | properties | ef:agent/enrich_references | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v7 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v8 |
| ef:activity/change/20260821T1554374006150000/231431 | skos_definition | ef:agent/enrich_references | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v8 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v9 |
| ef:activity/change/20260821T1554374006150000/231432 | references | ef:agent/enrich_references | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v9 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v10 |
| ef:activity/change/20260821T1554374006150000/249540 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v10 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v11 |
| ef:activity/change/20260821T1554374006150000/271707 | altLabel | ef:agent/consensus_match | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v11 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v12 |
| ef:activity/change/20260821T1554374006150000/271708 | cas_match_labels | ef:agent/consensus_match | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v12 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v13 |
| ef:activity/change/20260821T1554374006150000/274671 | properties | ef:agent/opsin_iupac | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v13 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v14 |
| ef:activity/change/20260821T1554374006150000/281130 | properties | ef:agent/rdkit_post_consensus | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v14 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v15 |
| ef:activity/change/20260821T1554374006150000/369393 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v15 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v16 |
| ef:activity/change/20260821T1554374006150000/388978 | properties | ef:agent/normalise_property_values | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v16 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v17 |
| ef:activity/change/20260821T1554374006150000/395938 | types | ef:agent/link_flows_to_their_substance | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v17 | ef:flow/d660df40-300d-4c1a-83b6-98eb27e6aa3d/v18 |