Hexasodium 2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})dibenzene-1,4-disulfonate
Everything that changed this flow. Back to the flow
53b49964-c371-4309-97be-c521749347b7
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=hexasodium2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})dibenzene-1,4-disulfonate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=41098-56-0; added Common Chemistry CAS names as altLabel: 1,4-Benzenedisulfonic acid, 2,2′-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis-, hexasodium salt, 1,4-Benzenedisulfonic acid, 2,2′-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis-, sodium salt (1:6), 2,2′-(1,2-Ethenediyl)bis[5-[[4-(diethylamino)-6-[(2,5-disulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid] hexasodium salt, Fluorescent brightener 357, Hexasodium 2,2′-[vinylenebis[(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis[benzene-1,4-disulfonate]; object_uuid=fo-cc7c85f6799522f4 |
| cas_match_labels | 1 | consensus_match | group_key=hexasodium2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})dibenzene-1,4-disulfonate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory']; cas_sources={'41098-56-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-cc7c85f6799522f4: {'41098-56-0': '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 water > Emissions to water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['41098-56-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[3034474, 6436733, 131853713, 136849160, 156593808, 169440710, 175675787, 177784372]; selected_pubchem_cids=[131853713]; 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 |
|---|---|---|---|---|---|
| 16,714 | bootstrap_labels | prefLabel | — | [{"@value":"hexasodium 2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-di… | Bootstrapped prefLabel from legacy name field |
| 16,715 | bootstrap_labels | name | hexasodium 2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})di… | — | Purged legacy name field to enforce prefLabel usage |
| 16,716 | bootstrap_labels | synonyms | ["organic","hexasodium2,2'","-[vinylenebis[(3-sulphonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-di… | [] | Removed legacy synonyms field in favor of structured labels |
| 99,646 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 99,647 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 218,822 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,918 | normalize_name_case | prefLabel | [{"@value":"hexasodium 2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-di… | [{"@value":"Hexasodium 2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-di… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,888 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H44N12N… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 242,889 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,890 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=41098-56-0","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['41098-56-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[3034474, 6436733, 131853713, 136849160, 156593808, 169440710, 175675787, 177784372]; selected_pubchem_cids=[131853713]; 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 |
| 252,842 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H44N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H44N12N… | rdkit_pre_consensus from 'CCN(CC)C1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)N(CC)CC)NC6=C(C=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.[Na].[Na].[Na].[Na].[Na].[Na]'; added: molecular_mass, monoisotopic_mass |
| 267,704 | consensus_match | altLabel | [] | [{"@value":"1,4-Benzenedisulfonic acid, 2,2′-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5-tri… | group_key=hexasodium2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})dibenzene-1,4-disulfonate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=41098-56-0; added Common Chemistry CAS names as altLabel: 1,4-Benzenedisulfonic acid, 2,2′-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis-, hexasodium salt, 1,4-Benzenedisulfonic acid, 2,2′-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis-, sodium salt (1:6), 2,2′-(1,2-Ethenediyl)bis[5-[[4-(diethylamino)-6-[(2,5-disulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid] hexasodium salt, Fluorescent brightener 357, Hexasodium 2,2′-[vinylenebis[(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis[benzene-1,4-disulfonate]; object_uuid=fo-cc7c85f6799522f4 |
| 267,705 | consensus_match | cas_match_labels | — | {"41098-56-0":"exactMatch"} | group_key=hexasodium2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})dibenzene-1,4-disulfonate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory']; cas_sources={'41098-56-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-cc7c85f6799522f4: {'41098-56-0': 'exactMatch'} |
| 278,046 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H44N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H44N12N… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Hexasodium 2,2'-(ethene-1,2-diylbis{(3-sulfonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino})dibenzene-1,4-disulfonate' |
| 284,776 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H44N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H38N12N… | rdkit_post_consensus from 'CCN(CC)c1nc(Nc2ccc(C=Cc3ccc(Nc4nc(Nc5cc(S(=O)(=O)[O-])ccc5S(=O)(=O)[O-])nc(N(CC)CC)n4)cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)nc(Nc2cc(S(=O)(=O)[O-])ccc2S(=O)(=O)[O-])n1.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 287,091 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H38N12N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H38N12N… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 330,820 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/53b49964-c371-… | associations resolved on the elementary layer |
| 400,852 | 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/20260822T0600486828500000/16714 | prefLabel | ef:agent/bootstrap_labels | ef:flow/53b49964-c371-4309-97be-c521749347b7/v0 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v1 |
| ef:activity/change/20260822T0600486828500000/16715 | name | ef:agent/bootstrap_labels | ef:flow/53b49964-c371-4309-97be-c521749347b7/v1 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v2 |
| ef:activity/change/20260822T0600486828500000/16716 | synonyms | ef:agent/bootstrap_labels | ef:flow/53b49964-c371-4309-97be-c521749347b7/v2 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v3 |
| ef:activity/change/20260822T0600486828500000/99646 | context | ef:agent/default_context_mapping | ef:flow/53b49964-c371-4309-97be-c521749347b7/v3 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v4 |
| ef:activity/change/20260822T0600486828500000/99647 | context_iri | ef:agent/default_context_mapping | ef:flow/53b49964-c371-4309-97be-c521749347b7/v4 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v5 |
| ef:activity/change/20260822T0600486828500000/218822 | unit_iri | ef:agent/unit_normalization | ef:flow/53b49964-c371-4309-97be-c521749347b7/v5 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v6 |
| ef:activity/change/20260822T0600486828500000/224918 | prefLabel | ef:agent/normalize_name_case | ef:flow/53b49964-c371-4309-97be-c521749347b7/v6 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v7 |
| ef:activity/change/20260822T0600486828500000/242888 | properties | ef:agent/enrich_references | ef:flow/53b49964-c371-4309-97be-c521749347b7/v7 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v8 |
| ef:activity/change/20260822T0600486828500000/242889 | skos_definition | ef:agent/enrich_references | ef:flow/53b49964-c371-4309-97be-c521749347b7/v8 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v9 |
| ef:activity/change/20260822T0600486828500000/242890 | references | ef:agent/enrich_references | ef:flow/53b49964-c371-4309-97be-c521749347b7/v9 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v10 |
| ef:activity/change/20260822T0600486828500000/252842 | properties | ef:agent/rdkit_pre_consensus | ef:flow/53b49964-c371-4309-97be-c521749347b7/v10 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v11 |
| ef:activity/change/20260822T0600486828500000/267704 | altLabel | ef:agent/consensus_match | ef:flow/53b49964-c371-4309-97be-c521749347b7/v11 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v12 |
| ef:activity/change/20260822T0600486828500000/267705 | cas_match_labels | ef:agent/consensus_match | ef:flow/53b49964-c371-4309-97be-c521749347b7/v12 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v13 |
| ef:activity/change/20260822T0600486828500000/278046 | properties | ef:agent/opsin_iupac | ef:flow/53b49964-c371-4309-97be-c521749347b7/v13 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v14 |
| ef:activity/change/20260822T0600486828500000/284776 | properties | ef:agent/rdkit_post_consensus | ef:flow/53b49964-c371-4309-97be-c521749347b7/v14 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v15 |
| ef:activity/change/20260822T0600486828500000/287091 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/53b49964-c371-4309-97be-c521749347b7/v15 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v16 |
| ef:activity/change/20260822T0600486828500000/330820 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/53b49964-c371-4309-97be-c521749347b7/v16 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v17 |
| ef:activity/change/20260822T0600486828500000/400852 | types | ef:agent/link_flows_to_their_substance | ef:flow/53b49964-c371-4309-97be-c521749347b7/v17 | ef:flow/53b49964-c371-4309-97be-c521749347b7/v18 |