Tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]
Everything that changed this flow. Back to the flow
628ea0c7-98ea-45ca-807c-b3117ad67946
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 1 catalogue altLabel value(s): 'Fluorescent Brightener 210' (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-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'28950-61-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-35fd84f95f648300: {'28950-61-0': '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 air, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['28950-61-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[6434593, 6440893, 14692718, 72737827, 129893786, 131852125, 136918648, 137698355, 156592244, 170919861, 171369589]; selected_pubchem_cids=[131852125]; 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 |
|---|---|---|---|---|---|
| 11,139 | bootstrap_labels | prefLabel | — | [{"@value":"tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}am… | Bootstrapped prefLabel from legacy name field |
| 11,140 | bootstrap_labels | name | tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenes… | — | Purged legacy name field to enforce prefLabel usage |
| 11,141 | bootstrap_labels | synonyms | ["tetrasodium4,4'","-bis[[4-morpholino-6-(p-sulphonatoanilino)-1,3,5-triazin-2-yl]amino]stilbene-2,2'","-disulp… | [] | Removed legacy synonyms field in favor of structured labels |
| 108,320 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 108,321 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 217,032 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,693 | normalize_name_case | prefLabel | [{"@value":"tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}am… | [{"@value":"Tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}am… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 237,779 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H40N12N… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 237,780 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,781 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=28950-61-0","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['28950-61-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[6434593, 6440893, 14692718, 72737827, 129893786, 131852125, 136918648, 137698355, 156592244, 170919861, 171369589]; selected_pubchem_cids=[131852125]; 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 |
| 251,362 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H40N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H40N12N… | rdkit_pre_consensus from 'C1COCCN1C2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)O)N7CCOCC7)S(=O)(=O)O)S(=O)(=O)O)NC8=CC=C(C=C8)S(=O)(=O)O.[Na].[Na].[Na].[Na]'; added: molecular_mass, monoisotopic_mass |
| 272,515 | consensus_match | altLabel | [] | [{"@value":"2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-morpholino-6-(<em>p</em>-sulfoanilino)-<em>s</em>-triazin-2-yl]am… | group_key=tetrasodium2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]||dimension=Environmental > media=Water > water_body=Unknown; cas=28950-61-0; added Common Chemistry CAS names as altLabel: 2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-morpholino-6-(<em>p</em>-sulfoanilino)-<em>s</em>-triazin-2-yl]amino]-, tetrasodium salt, Benzenesulfonic acid, 2,2′-(1,2-ethenediyl)bis[5-[[4-(4-morpholinyl)-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-, sodium salt (1:4), Benzenesulfonic acid, 2,2′-(1,2-ethenediyl)bis[5-[[4-(4-morpholinyl)-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-, tetrasodium salt, C.I. Fluorescent Brightener 210, C.I. Fluorescent Brightener 211, Fluorescent Brightener 210, Photine BTM; object_uuid=fo-35fd84f95f648300 |
| 272,516 | consensus_match | cas_match_labels | — | {"28950-61-0":"exactMatch"} | group_key=tetrasodium2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'28950-61-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-35fd84f95f648300: {'28950-61-0': 'exactMatch'} |
| 276,540 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H40N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H40N12N… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tetrasodium 2,2'-ethene-1,2-diylbis[5-({4-morpholin-4-yl-6-[(4-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]' |
| 283,155 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H40N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H36N12N… | rdkit_post_consensus from 'O=S(=O)([O-])c1ccc(Nc2nc(Nc3ccc(C=Cc4ccc(Nc5nc(Nc6ccc(S(=O)(=O)[O-])cc6)nc(N6CCOCC6)n5)cc4S(=O)(=O)[O-])c(S(=O)(=O)[O-])c3)nc(N3CCOCC3)n2)cc1.[Na+].[Na+].[Na+].[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,951 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H36N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H36N12N… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 289,559 | strip_catalogue_altlabels | altLabel | [{"@value":"2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-morpholino-6-(<em>p</em>-sulfoanilino)-<em>s</em>-triazin-2-yl]am… | [{"@value":"2,2′-Stilbenedisulfonic acid, 4,4′-bis[[4-morpholino-6-(p-sulfoanilino)-s-triazin-2-yl]amino]-, tetrasodium… | Removed 1 catalogue altLabel value(s): 'Fluorescent Brightener 210' (trade name) |
| 335,156 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/628ea0c7-98ea-… | associations resolved on the elementary layer |
| 398,705 | 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/20260821T1122181958110000/11139 | prefLabel | ef:agent/bootstrap_labels | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v0 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v1 |
| ef:activity/change/20260821T1122181958110000/11140 | name | ef:agent/bootstrap_labels | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v1 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v2 |
| ef:activity/change/20260821T1122181958110000/11141 | synonyms | ef:agent/bootstrap_labels | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v2 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v3 |
| ef:activity/change/20260821T1122181958110000/108320 | context | ef:agent/default_context_mapping | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v3 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v4 |
| ef:activity/change/20260821T1122181958110000/108321 | context_iri | ef:agent/default_context_mapping | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v4 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v5 |
| ef:activity/change/20260821T1122181958110000/217032 | unit_iri | ef:agent/unit_normalization | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v5 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v6 |
| ef:activity/change/20260821T1122181958110000/223693 | prefLabel | ef:agent/normalize_name_case | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v6 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v7 |
| ef:activity/change/20260821T1122181958110000/237779 | properties | ef:agent/enrich_references | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v7 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v8 |
| ef:activity/change/20260821T1122181958110000/237780 | skos_definition | ef:agent/enrich_references | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v8 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v9 |
| ef:activity/change/20260821T1122181958110000/237781 | references | ef:agent/enrich_references | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v9 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v10 |
| ef:activity/change/20260821T1122181958110000/251362 | properties | ef:agent/rdkit_pre_consensus | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v10 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v11 |
| ef:activity/change/20260821T1122181958110000/272515 | altLabel | ef:agent/consensus_match | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v11 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v12 |
| ef:activity/change/20260821T1122181958110000/272516 | cas_match_labels | ef:agent/consensus_match | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v12 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v13 |
| ef:activity/change/20260821T1122181958110000/276540 | properties | ef:agent/opsin_iupac | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v13 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v14 |
| ef:activity/change/20260821T1122181958110000/283155 | properties | ef:agent/rdkit_post_consensus | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v14 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v15 |
| ef:activity/change/20260821T1122181958110000/286951 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v15 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v16 |
| ef:activity/change/20260821T1122181958110000/289559 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v16 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v17 |
| ef:activity/change/20260821T1122181958110000/335156 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v17 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v18 |
| ef:activity/change/20260821T1122181958110000/398705 | types | ef:agent/link_flows_to_their_substance | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v18 | ef:flow/628ea0c7-98ea-45ca-807c-b3117ad67946/v19 |