Dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, Disodium Salt
Everything that changed this flow. Back to the flow
081e951f-e83b-4e20-ae9e-7fc5d89ae546
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 9 catalogue altLabel value(s): 'AB 9' (grade code), 'AB 9 (dye)' (grade code), 'Basacid Blue 756' (trade name), 'Blue 1' (grade code), 'Blue 1206' (grade code), 'C.I. 42090' (registry code), 'E 133' (grade code), 'E 133 (dye)' (grade code), 'RM 4044' (grade code) |
| 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=dihydrogen(ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium,disodiumsalt||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory']; cas_sources={'3844-45-9': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-db0cf3e2f60fa01e: {'3844-45-9': '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 water > Emissions to fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['3844-45-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82411']; candidate_pubchem_cids=[17559, 17560, 19700, 58779747, 101116159, 131853261, 137345951, 156592313, 176489203]; selected_pubchem_cids=[19700]; 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 |
|---|---|---|---|---|---|
| 5,617 | bootstrap_labels | prefLabel | — | [{"@value":"dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1… | Bootstrapped prefLabel from legacy name field |
| 5,618 | bootstrap_labels | name | dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-… | — | Purged legacy name field to enforce prefLabel usage |
| 5,619 | bootstrap_labels | synonyms | ["1206 Blue","AC1L2EO5","Acid Blue 9","Acid Blue 9, disodium salt","Aizen Food Blue No. 2","Alphazurine FG","B0790","Bi… | [] | Removed legacy synonyms field in favor of structured labels |
| 31,555 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 31,556 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 215,218 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,398 | normalize_name_case | prefLabel | [{"@value":"dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1… | [{"@value":"Dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,588 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,589 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,590 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=3844-45-9","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['3844-45-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82411']; candidate_pubchem_cids=[17559, 17560, 19700, 58779747, 101116159, 131853261, 137345951, 156592313, 176489203]; selected_pubchem_cids=[19700]; 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 |
| 249,878 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | rdkit_pre_consensus from 'CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5S(=O)(=O)[O-].[Na+].[Na+]'; added: monoisotopic_mass |
| 255,092 | chebi_altlabels | altLabel | [] | [{"@value":"Brilliant Blue FCF, disodium salt","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | Added 1 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 265,980 | consensus_match | altLabel | [{"@value":"Brilliant Blue FCF, disodium salt","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | [{"@value":"Brilliant Blue FCF, disodium salt","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | group_key=dihydrogen(ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium,disodiumsalt||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=3844-45-9; added Common Chemistry CAS names as altLabel: AB 9, AB 9 (dye), Acid Blue 9, Basacid Blue 756, Basacid Blue 756 Liquid, Benzenemethanaminium, <em>N</em>-ethyl-<em>N</em>-[4-[[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl](2-sulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-3-sulfo-, hydroxide, inner salt, disodium salt, Benzenemethanaminium, <em>N</em>-ethyl-<em>N</em>-[4-[[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl](2-sulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-3-sulfo-, inner salt, disodium salt, Benzenemethanaminium, <em>N</em>-ethyl-<em>N</em>-[4-[[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl](2-sulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-3-sulfo-, inner salt, sodium salt (1:2), Blue 1, Blue 1206, Blue FCF, Blue No. 1, Brilliant Blue, Brilliant Blue E 133, Brilliant Blue FCF, Brilliant Blue FCF Supra, C.I. 42090, C.I. Acid Blue 9, disodium salt, C.I. Food Blue 2, Canacert Brilliant Blue FCF, D and C Blue No. 1, D&C Blue No. 1, Disodium erioglaucine, Dolkwal Brilliant Blue, Duasyn Acid Blue AE 02, E 133, E 133 (dye), E133 Brilliant Blue FCF Granular, E133 Granular, Erioglaucine disodium salt, FD and C Blue 1, FD and C Blue No. 1, FD&C Blue No. 1, FDC Blue 1, Food Blue 1, Food Blue 2, Food Blue 2 CI 42090, Food Blue Dye No. 1, Food Blue No. 1, Food Blue No. 2, Food Brilliant blue, Hexacol Brilliant Blue A, Iragon Blue ABL9 HFC, Iragon Blue ABL9-L HFC, Japan Blue 1, Japan Blue No. 1, Japan Food Blue 1, Japan Food Blue No. 1, K-RCP-B 1AL, Kayaset Blue J-FG, Puricolor Blue ABL 9, RM 4044, Sicovit Brilliant Blue 85E133, Unicert Blue O 5601J, Usacert Blue No. 1, Usacert FD and C Blue No. 1; object_uuid=fo-db0cf3e2f60fa01e |
| 265,981 | consensus_match | cas_match_labels | — | {"3844-45-9":"exactMatch"} | group_key=dihydrogen(ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium,disodiumsalt||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory']; cas_sources={'3844-45-9': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-db0cf3e2f60fa01e: {'3844-45-9': 'exactMatch'} |
| 281,503 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | rdkit_post_consensus from 'CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5S(=O)(=O)[O-].[Na+].[Na+]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,414 | strip_catalogue_altlabels | altLabel | [{"@value":"Brilliant Blue FCF, disodium salt","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | [{"@value":"Brilliant Blue FCF, disodium salt","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov… | Removed 9 catalogue altLabel value(s): 'AB 9' (grade code), 'AB 9 (dye)' (grade code), 'Basacid Blue 756' (trade name), 'Blue 1' (grade code), 'Blue 1206' (grade code), 'C.I. 42090' (registry code), 'E 133' (grade code), 'E 133 (dye)' (grade code), 'RM 4044' (grade code) |
| 296,857 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/081e951f-e83b-… | associations resolved on the elementary layer |
| 389,350 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C37H34N2Na… | typed the way the ontology types it |
| 396,441 | 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/20261019T0712047113160000/5617 | prefLabel | ef:agent/bootstrap_labels | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v0 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v1 |
| ef:activity/change/20261019T0712047113160000/5618 | name | ef:agent/bootstrap_labels | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v1 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v2 |
| ef:activity/change/20261019T0712047113160000/5619 | synonyms | ef:agent/bootstrap_labels | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v2 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v3 |
| ef:activity/change/20261019T0712047113160000/31555 | context | ef:agent/default_context_mapping | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v3 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v4 |
| ef:activity/change/20261019T0712047113160000/31556 | context_iri | ef:agent/default_context_mapping | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v4 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v5 |
| ef:activity/change/20261019T0712047113160000/215218 | unit_iri | ef:agent/unit_normalization | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v5 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v6 |
| ef:activity/change/20261019T0712047113160000/222398 | prefLabel | ef:agent/normalize_name_case | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v6 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v7 |
| ef:activity/change/20261019T0712047113160000/232588 | properties | ef:agent/enrich_references | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v7 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v8 |
| ef:activity/change/20261019T0712047113160000/232589 | skos_definition | ef:agent/enrich_references | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v8 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v9 |
| ef:activity/change/20261019T0712047113160000/232590 | references | ef:agent/enrich_references | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v9 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v10 |
| ef:activity/change/20261019T0712047113160000/249878 | properties | ef:agent/rdkit_pre_consensus | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v10 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v11 |
| ef:activity/change/20261019T0712047113160000/255092 | altLabel | ef:agent/chebi_altlabels | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v11 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v12 |
| ef:activity/change/20261019T0712047113160000/265980 | altLabel | ef:agent/consensus_match | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v12 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v13 |
| ef:activity/change/20261019T0712047113160000/265981 | cas_match_labels | ef:agent/consensus_match | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v13 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v14 |
| ef:activity/change/20261019T0712047113160000/281503 | properties | ef:agent/rdkit_post_consensus | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v14 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v15 |
| ef:activity/change/20261019T0712047113160000/288414 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v15 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v16 |
| ef:activity/change/20261019T0712047113160000/296857 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v16 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v17 |
| ef:activity/change/20261019T0712047113160000/389350 | properties | ef:agent/normalise_property_values | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v17 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v18 |
| ef:activity/change/20261019T0712047113160000/396441 | types | ef:agent/link_flows_to_their_substance | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v18 | ef:flow/081e951f-e83b-4e20-ae9e-7fc5d89ae546/v19 |