3-amino-4-hydroxy-5-nitrobenzenesulphonic Acid
Everything that changed this flow. Back to the flow
83a46d1f-2670-4710-99fd-bb86719bdc4f
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types 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=3-amino-4-hydroxy-5-nitrobenzenesulphonicacid||dimension=Environmental > media=Water > water_body=Ocean; cas=96-93-5; added Common Chemistry CAS names as altLabel: 1-Amino-2-hydroxy-3-nitro-5-benzenesulfonic acid, 1-Phenol-4-sulfonic acid, 2-amino-6-nitro-, 2-Amino-6-nitro-1-phenol-4-sulfonic acid, 2-Amino-6-nitro-4-sulfophenol, 2-Amino-6-nitrophenol-4-sulfonic acid, 2-Hydroxy-3-nitro-5-sulfoaniline, 3-Amino-4-hydroxy-5-nitrobenzene-1-sulfonic acid, 3-Amino-4-hydroxy-5-nitrobenzenesulfonic acid, 3-Amino-5-nitro-4-hydroxybenzenesulfonic acid, 4-Hydroxy-5-nitrometanilic acid, 6-Nitro-2-aminophenol-4-sulfonic acid, Benzenesulfonic acid, 3-amino-4-hydroxy-5-nitro-, Metanilic acid, 4-hydroxy-5-nitro-; object_uuid=fo-1d80f885e28fa89e |
| cas_match_labels | 1 | consensus_match | group_key=3-amino-4-hydroxy-5-nitrobenzenesulphonicacid||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'96-93-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-1d80f885e28fa89e: {'96-93-5': '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=['96-93-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[3844407]; selected_pubchem_cids=[3844407]; 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 |
|---|---|---|---|---|---|
| 18,342 | bootstrap_labels | prefLabel | — | [{"@value":"3-amino-4-hydroxy-5-nitrobenzenesulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | Bootstrapped prefLabel from legacy name field |
| 18,343 | bootstrap_labels | name | 3-amino-4-hydroxy-5-nitrobenzenesulphonic acid | — | Purged legacy name field to enforce prefLabel usage |
| 18,344 | bootstrap_labels | synonyms | ["organic","3-amino-4-hydroxy-5-nitrobenzenesulphonicacid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 128,030 | 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 |
| 128,031 | 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 |
| 219,335 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,272 | normalize_name_case | prefLabel | [{"@value":"3-amino-4-hydroxy-5-nitrobenzenesulphonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | [{"@value":"3-amino-4-hydroxy-5-nitrobenzenesulphonic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 244,326 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 244,327 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,328 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.942E","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['96-93-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[3844407]; selected_pubchem_cids=[3844407]; 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 |
| 253,257 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | rdkit_pre_consensus from 'C1=C(C=C(C(=C1N)O)[N+](=O)[O-])S(=O)(=O)O'; added: molecular_mass, monoisotopic_mass |
| 261,886 | consensus_match | altLabel | [] | [{"@value":"1-Amino-2-hydroxy-3-nitro-5-benzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"consens… | group_key=3-amino-4-hydroxy-5-nitrobenzenesulphonicacid||dimension=Environmental > media=Water > water_body=Ocean; cas=96-93-5; added Common Chemistry CAS names as altLabel: 1-Amino-2-hydroxy-3-nitro-5-benzenesulfonic acid, 1-Phenol-4-sulfonic acid, 2-amino-6-nitro-, 2-Amino-6-nitro-1-phenol-4-sulfonic acid, 2-Amino-6-nitro-4-sulfophenol, 2-Amino-6-nitrophenol-4-sulfonic acid, 2-Hydroxy-3-nitro-5-sulfoaniline, 3-Amino-4-hydroxy-5-nitrobenzene-1-sulfonic acid, 3-Amino-4-hydroxy-5-nitrobenzenesulfonic acid, 3-Amino-5-nitro-4-hydroxybenzenesulfonic acid, 4-Hydroxy-5-nitrometanilic acid, 6-Nitro-2-aminophenol-4-sulfonic acid, Benzenesulfonic acid, 3-amino-4-hydroxy-5-nitro-, Metanilic acid, 4-hydroxy-5-nitro-; object_uuid=fo-1d80f885e28fa89e |
| 261,887 | consensus_match | cas_match_labels | — | {"96-93-5":"exactMatch"} | group_key=3-amino-4-hydroxy-5-nitrobenzenesulphonicacid||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'96-93-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-1d80f885e28fa89e: {'96-93-5': 'exactMatch'} |
| 278,467 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-amino-4-hydroxy-5-nitrobenzenesulphonic Acid' |
| 285,231 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | rdkit_post_consensus from 'Nc1cc(S(=O)(=O)O)cc([N+](=O)[O-])c1O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 345,017 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/83a46d1f-2670-… | associations resolved on the elementary layer |
| 392,835 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O6S"… | typed the way the ontology types it |
| 401,491 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260821T1302361922970000/18342 | prefLabel | ef:agent/bootstrap_labels | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v0 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v1 |
| ef:activity/change/20260821T1302361922970000/18343 | name | ef:agent/bootstrap_labels | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v1 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v2 |
| ef:activity/change/20260821T1302361922970000/18344 | synonyms | ef:agent/bootstrap_labels | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v2 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v3 |
| ef:activity/change/20260821T1302361922970000/128030 | context | ef:agent/default_context_mapping | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v3 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v4 |
| ef:activity/change/20260821T1302361922970000/128031 | context_iri | ef:agent/default_context_mapping | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v4 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v5 |
| ef:activity/change/20260821T1302361922970000/219335 | unit_iri | ef:agent/unit_normalization | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v5 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v6 |
| ef:activity/change/20260821T1302361922970000/225272 | prefLabel | ef:agent/normalize_name_case | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v6 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v7 |
| ef:activity/change/20260821T1302361922970000/244326 | properties | ef:agent/enrich_references | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v7 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v8 |
| ef:activity/change/20260821T1302361922970000/244327 | skos_definition | ef:agent/enrich_references | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v8 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v9 |
| ef:activity/change/20260821T1302361922970000/244328 | references | ef:agent/enrich_references | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v9 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v10 |
| ef:activity/change/20260821T1302361922970000/253257 | properties | ef:agent/rdkit_pre_consensus | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v10 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v11 |
| ef:activity/change/20260821T1302361922970000/261886 | altLabel | ef:agent/consensus_match | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v11 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v12 |
| ef:activity/change/20260821T1302361922970000/261887 | cas_match_labels | ef:agent/consensus_match | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v12 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v13 |
| ef:activity/change/20260821T1302361922970000/278467 | properties | ef:agent/opsin_iupac | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v13 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v14 |
| ef:activity/change/20260821T1302361922970000/285231 | properties | ef:agent/rdkit_post_consensus | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v14 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v15 |
| ef:activity/change/20260821T1302361922970000/345017 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v15 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v16 |
| ef:activity/change/20260821T1302361922970000/392835 | properties | ef:agent/normalise_property_values | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v16 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v17 |
| ef:activity/change/20260821T1302361922970000/401491 | types | ef:agent/link_flows_to_their_substance | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v17 | ef:flow/83a46d1f-2670-4710-99fd-bb86719bdc4f/v18 |