Sodium 6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate
Everything that changed this flow. Back to the flow
b248d732-8168-4eed-ac42-2bfd53219d34
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=sodium6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'32846-21-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-204d74d88f0e5778: {'32846-21-2': '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=['32846-21-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[102269516, 135764918, 135801433, 137244899]; selected_pubchem_cids=[137244899]; 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 |
|---|---|---|---|---|---|
| 18,960 | bootstrap_labels | prefLabel | — | [{"@value":"sodium 6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate","@lang… | Bootstrapped prefLabel from legacy name field |
| 18,961 | bootstrap_labels | name | sodium 6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate | — | Purged legacy name field to enforce prefLabel usage |
| 18,962 | bootstrap_labels | synonyms | ["organic","sodium6-amino-5-[[2-[(cyclohexylmethylamino)sulphonyl]phenyl]azo]-4-hydroxynaphthalene-2-sulphonate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 155,792 | 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 |
| 155,793 | 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 |
| 219,523 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,409 | normalize_name_case | prefLabel | [{"@value":"sodium 6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate","@lang… | [{"@value":"Sodium 6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate","@lang… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 244,841 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H26N4Na… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 244,842 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,843 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=32846-21-2","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['32846-21-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[102269516, 135764918, 135801433, 137244899]; selected_pubchem_cids=[137244899]; 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 |
| 253,405 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H26N4Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H26N4Na… | rdkit_pre_consensus from 'CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2N=NC3=C(C=CC4=CC(=CC(=C43)O)S(=O)(=O)O)N.[Na]'; added: molecular_mass, monoisotopic_mass |
| 271,821 | consensus_match | altLabel | [] | [{"@value":"2-Naphthalenesulfonic acid, 6-amino-5-[2-[2-[(cyclohexylmethylamino)sulfonyl]phenyl]diazenyl]-4-hydroxy-, s… | group_key=sodium6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate||dimension=Environmental > media=Ground > geography=Unknown; cas=32846-21-2; added Common Chemistry CAS names as altLabel: 2-Naphthalenesulfonic acid, 6-amino-5-[2-[2-[(cyclohexylmethylamino)sulfonyl]phenyl]diazenyl]-4-hydroxy-, sodium salt (1:1), 2-Naphthalenesulfonic acid, 6-amino-5-[[2-[(cyclohexylmethylamino)sulfonyl]phenyl]azo]-4-hydroxy-, monosodium salt, 2-Naphthalenesulfonic acid, 6-amino-5-[[<em>o</em>-(cyclohexylmethylsulfamoyl)phenyl]azo]-4-hydroxy-, monosodium salt; object_uuid=fo-204d74d88f0e5778 |
| 271,822 | consensus_match | cas_match_labels | — | {"32846-21-2":"exactMatch"} | group_key=sodium6-amino-5-({2-[cyclohexyl(methyl)sulfamoyl]phenyl}diazenyl)-4-hydroxynaphthalene-2-sulfonate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'32846-21-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-204d74d88f0e5778: {'32846-21-2': 'exactMatch'} |
| 278,617 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H26N4Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H26N4Na… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-Naphthalenesulfonic acid, 6-amino-5-[2-[2-[(cyclohexylmethylamino)sulfonyl]phenyl]diazenyl]-4-hydroxy-, sodium salt (1:1)' |
| 285,394 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H26N4Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H25N4Na… | rdkit_post_consensus from 'Nc1ccc2cc(S(=O)(=O)[O-])cc(O)c2c1N=Nc1ccccc1S(=O)(=O)NCC1CCCCC1.[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 287,140 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H25N4Na… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C23H25N4Na… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 293,012 | dedupe_altlabels | altLabel | [{"@value":"2-Naphthalenesulfonic acid, 6-amino-5-[2-[2-[(cyclohexylmethylamino)sulfonyl]phenyl]diazenyl]-4-hydroxy-, s… | [{"@value":"2-Naphthalenesulfonic acid, 6-amino-5-[2-[2-[(cyclohexylmethylamino)sulfonyl]phenyl]diazenyl]-4-hydroxy-, s… | Deduplicated altLabel values and removed entries matching prefLabel |
| 358,920 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b248d732-8168-… | associations resolved on the elementary layer |
| 401,720 | 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/20260821T1302361922970000/18960 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v0 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v1 |
| ef:activity/change/20260821T1302361922970000/18961 | name | ef:agent/bootstrap_labels | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v1 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v2 |
| ef:activity/change/20260821T1302361922970000/18962 | synonyms | ef:agent/bootstrap_labels | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v2 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v3 |
| ef:activity/change/20260821T1302361922970000/155792 | context | ef:agent/default_context_mapping | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v3 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v4 |
| ef:activity/change/20260821T1302361922970000/155793 | context_iri | ef:agent/default_context_mapping | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v4 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v5 |
| ef:activity/change/20260821T1302361922970000/219523 | unit_iri | ef:agent/unit_normalization | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v5 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v6 |
| ef:activity/change/20260821T1302361922970000/225409 | prefLabel | ef:agent/normalize_name_case | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v6 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v7 |
| ef:activity/change/20260821T1302361922970000/244841 | properties | ef:agent/enrich_references | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v7 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v8 |
| ef:activity/change/20260821T1302361922970000/244842 | skos_definition | ef:agent/enrich_references | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v8 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v9 |
| ef:activity/change/20260821T1302361922970000/244843 | references | ef:agent/enrich_references | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v9 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v10 |
| ef:activity/change/20260821T1302361922970000/253405 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v10 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v11 |
| ef:activity/change/20260821T1302361922970000/271821 | altLabel | ef:agent/consensus_match | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v11 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v12 |
| ef:activity/change/20260821T1302361922970000/271822 | cas_match_labels | ef:agent/consensus_match | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v12 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v13 |
| ef:activity/change/20260821T1302361922970000/278617 | properties | ef:agent/opsin_iupac | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v13 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v14 |
| ef:activity/change/20260821T1302361922970000/285394 | properties | ef:agent/rdkit_post_consensus | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v14 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v15 |
| ef:activity/change/20260821T1302361922970000/287140 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v15 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v16 |
| ef:activity/change/20260821T1302361922970000/293012 | altLabel | ef:agent/dedupe_altlabels | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v16 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v17 |
| ef:activity/change/20260821T1302361922970000/358920 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v17 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v18 |
| ef:activity/change/20260821T1302361922970000/401720 | types | ef:agent/link_flows_to_their_substance | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v18 | ef:flow/b248d732-8168-4eed-ac42-2bfd53219d34/v19 |