Tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]
Everything that changed this flow. Back to the flow
dfb357e2-440d-431e-84db-641336c95678
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, strip_catalogue_altlabels | Removed 3 catalogue altLabel value(s): 'C.I. 406233' (registry code), 'Fluorescent Brightener 114' (trade name), 'Fluorescent Brightener 251' (trade name) |
| 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=tetrasodium2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory']; cas_sources={'16324-27-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-b58810932c9b61e3: {'16324-27-9': '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 agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['16324-27-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[6440853, 14366579, 72730411, 129893743, 131849298, 136918658, 138395848]; selected_pubchem_cids=[131849298]; 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 |
|---|---|---|---|---|---|
| 21,053 | bootstrap_labels | prefLabel | — | [{"@value":"tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazi… | Bootstrapped prefLabel from legacy name field |
| 21,054 | bootstrap_labels | name | tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino… | — | Purged legacy name field to enforce prefLabel usage |
| 21,055 | bootstrap_labels | synonyms | ["organic","tetrasodium4,4'","-bis[[4-[(2-hydroxyethyl)amino]-6-(m-sulphonatoanilino)-1,3,5-triazin-2-yl]amino]stil… | [] | Removed legacy synonyms field in favor of structured labels |
| 183,042 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 183,043 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 220,122 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,862 | normalize_name_case | prefLabel | [{"@value":"tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazi… | [{"@value":"Tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazi… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 246,527 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H36N12N… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 246,528 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,529 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=16324-27-9","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['16324-27-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[6440853, 14366579, 72730411, 129893743, 131849298, 136918658, 138395848]; selected_pubchem_cids=[131849298]; 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 |
| 253,903 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H36N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H36N12N… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)S(=O)(=O)O)NC2=NC(=NC(=N2)NCCO)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC(=CC=C6)S(=O)(=O)O)NCCO)S(=O)(=O)O)S(=O)(=O)O.[Na].[Na].[Na].[Na]'; added: molecular_mass, monoisotopic_mass |
| 272,511 | consensus_match | altLabel | [] | [{"@value":"2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-[(2-hydroxyethyl)amino]-6-(<em>m</em>-sulfoanilino)-<em>s</em>-tr… | group_key=tetrasodium2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=16324-27-9; added Common Chemistry CAS names as altLabel: 2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-[(2-hydroxyethyl)amino]-6-(<em>m</em>-sulfoanilino)-<em>s</em>-triazin-2-yl]amino]-, tetrasodium salt, BLT, BLT (brightener), Benzenesulfonic acid, 2,2′-(1,2-ethenediyl)bis[5-[[4-[(2-hydroxyethyl)amino]-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-, sodium salt (1:4), Benzenesulfonic acid, 2,2′-(1,2-ethenediyl)bis[5-[[4-[(2-hydroxyethyl)amino]-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-, tetrasodium salt, C.I. 406233, C.I. Fluorescent Brightener 114, C.I. Fluorescent Brightener 251, C.I. Fluorescent Brightening Agent 114, CAS, Fluorescent Brightener 114, Fluorescent Brightener 251, Heliofor CAF, Heliofor CAS, Phorwite BBU, Tinopal 2BT, Ultraphor GPB, Uvitex 2BT, Wobital BBK; object_uuid=fo-b58810932c9b61e3 |
| 272,512 | consensus_match | cas_match_labels | — | {"16324-27-9":"exactMatch"} | group_key=tetrasodium2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory']; cas_sources={'16324-27-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-b58810932c9b61e3: {'16324-27-9': 'exactMatch'} |
| 279,090 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H36N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H36N12N… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-[(2-hydroxyethyl)amino]-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]' |
| 285,938 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H36N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H32N12N… | rdkit_post_consensus from 'O=S(=O)([O-])c1cccc(Nc2nc(NCCO)nc(Nc3ccc(C=Cc4ccc(Nc5nc(NCCO)nc(Nc6cccc(S(=O)(=O)[O-])c6)n5)cc4S(=O)(=O)[O-])c(S(=O)(=O)[O-])c3)n2)c1.[Na+].[Na+].[Na+].[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 287,192 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H32N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C36H32N12N… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 291,409 | strip_catalogue_altlabels | altLabel | [{"@value":"2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-[(2-hydroxyethyl)amino]-6-(<em>m</em>-sulfoanilino)-<em>s</em>-tr… | [{"@value":"2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-[(2-hydroxyethyl)amino]-6-(m-sulfoanilino)-s-triazin-2-yl]amino]-… | Removed 3 catalogue altLabel value(s): 'C.I. 406233' (registry code), 'Fluorescent Brightener 114' (trade name), 'Fluorescent Brightener 251' (trade name) |
| 372,548 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/dfb357e2-440d-… | associations resolved on the elementary layer |
| 402,477 | 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/20260821T1554374006150000/21053 | prefLabel | ef:agent/bootstrap_labels | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v0 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v1 |
| ef:activity/change/20260821T1554374006150000/21054 | name | ef:agent/bootstrap_labels | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v1 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v2 |
| ef:activity/change/20260821T1554374006150000/21055 | synonyms | ef:agent/bootstrap_labels | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v2 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v3 |
| ef:activity/change/20260821T1554374006150000/183042 | context | ef:agent/default_context_mapping | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v3 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v4 |
| ef:activity/change/20260821T1554374006150000/183043 | context_iri | ef:agent/default_context_mapping | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v4 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v5 |
| ef:activity/change/20260821T1554374006150000/220122 | unit_iri | ef:agent/unit_normalization | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v5 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v6 |
| ef:activity/change/20260821T1554374006150000/225862 | prefLabel | ef:agent/normalize_name_case | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v6 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v7 |
| ef:activity/change/20260821T1554374006150000/246527 | properties | ef:agent/enrich_references | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v7 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v8 |
| ef:activity/change/20260821T1554374006150000/246528 | skos_definition | ef:agent/enrich_references | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v8 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v9 |
| ef:activity/change/20260821T1554374006150000/246529 | references | ef:agent/enrich_references | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v9 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v10 |
| ef:activity/change/20260821T1554374006150000/253903 | properties | ef:agent/rdkit_pre_consensus | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v10 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v11 |
| ef:activity/change/20260821T1554374006150000/272511 | altLabel | ef:agent/consensus_match | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v11 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v12 |
| ef:activity/change/20260821T1554374006150000/272512 | cas_match_labels | ef:agent/consensus_match | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v12 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v13 |
| ef:activity/change/20260821T1554374006150000/279090 | properties | ef:agent/opsin_iupac | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v13 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v14 |
| ef:activity/change/20260821T1554374006150000/285938 | properties | ef:agent/rdkit_post_consensus | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v14 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v15 |
| ef:activity/change/20260821T1554374006150000/287192 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v15 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v16 |
| ef:activity/change/20260821T1554374006150000/291409 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v16 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v17 |
| ef:activity/change/20260821T1554374006150000/372548 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v17 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v18 |
| ef:activity/change/20260821T1554374006150000/402477 | types | ef:agent/link_flows_to_their_substance | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v18 | ef:flow/dfb357e2-440d-431e-84db-641336c95678/v19 |