3-amino-2-hydroxy-5-nitrobenzenesulfonic Acid
Everything that changed this flow. Back to the flow
8c0f0fe6-8576-4f14-892e-75c97cfdc0e0
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 |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 7541' (registry 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=3-amino-2-hydroxy-5-nitrobenzenesulfonicacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'96-67-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f6b4f526f1ac4fc5: {'96-67-3': '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=['96-67-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[4312530, 70700140]; selected_pubchem_cids=[4312530]; 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 |
|---|---|---|---|---|---|
| 5,202 | bootstrap_labels | prefLabel | — | [{"@value":"3-amino-2-hydroxy-5-nitrobenzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_… | Bootstrapped prefLabel from legacy name field |
| 5,203 | bootstrap_labels | name | 3-amino-2-hydroxy-5-nitrobenzenesulfonic acid | — | Purged legacy name field to enforce prefLabel usage |
| 5,204 | bootstrap_labels | synonyms | ["organic","3-amino-2-hydroxy-5-nitrobenzenesulphonicacid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 133,142 | 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 |
| 133,143 | 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 |
| 215,077 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,293 | normalize_name_case | prefLabel | [{"@value":"3-amino-2-hydroxy-5-nitrobenzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_… | [{"@value":"3-amino-2-hydroxy-5-nitrobenzenesulfonic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,182 | 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) |
| 232,183 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,184 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J53.686E","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['96-67-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[4312530, 70700140]; selected_pubchem_cids=[4312530]; 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 |
| 249,752 | 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)S(=O)(=O)O)[N+](=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 261,880 | consensus_match | altLabel | [] | [{"@value":"1-Amino-2-hydroxy-5-nitro-3-benzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"consens… | group_key=3-amino-2-hydroxy-5-nitrobenzenesulfonicacid||dimension=Environmental > media=Water > water_body=Surface water; cas=96-67-3; added Common Chemistry CAS names as altLabel: 1-Amino-2-hydroxy-5-nitro-3-benzenesulfonic acid, 1-Hydroxy-2-amino-4-nitrobenzene-6-sulfonic acid, 1-Phenol-2-sulfonic acid, 6-amino-4-nitro-, 2-Amino-4-nitro-6-sulfophenol, 2-Amino-4-nitrophenol-6-sulfonic acid, 2-Aminophenol-4-nitro-6-sulfonic acid, 2-Hydroxy-5-nitro-3-sulfoaniline, 3-Amino-2-hydroxy-5-nitrobenzene-1-sulfonic acid, 4-Nitro-2-aminophenol-6-sulfonic acid, 6-Amino-4-nitro-1-phenol-2-sulfonic acid, 6-Amino-4-nitrophenol-2-sulfonic acid, Benzenesulfonic acid, 3-amino-2-hydroxy-5-nitro-, Metanilic acid, 2-hydroxy-5-nitro-, NSC 7541; object_uuid=fo-f6b4f526f1ac4fc5 |
| 261,881 | consensus_match | cas_match_labels | — | {"96-67-3":"exactMatch"} | group_key=3-amino-2-hydroxy-5-nitrobenzenesulfonicacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'96-67-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f6b4f526f1ac4fc5: {'96-67-3': 'exactMatch'} |
| 274,889 | 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-2-hydroxy-5-nitrobenzenesulfonic Acid' |
| 281,364 | 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([N+](=O)[O-])cc(S(=O)(=O)O)c1O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,320 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Amino-2-hydroxy-5-nitro-3-benzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"consens… | [{"@value":"1-Amino-2-hydroxy-5-nitro-3-benzenesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"consens… | Removed 1 catalogue altLabel value(s): 'NSC 7541' (registry code) |
| 347,564 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8c0f0fe6-8576-… | associations resolved on the elementary layer |
| 389,196 | 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 |
| 396,243 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260821T1122181958110000/5202 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v0 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v1 |
| ef:activity/change/20260821T1122181958110000/5203 | name | ef:agent/bootstrap_labels | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v1 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v2 |
| ef:activity/change/20260821T1122181958110000/5204 | synonyms | ef:agent/bootstrap_labels | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v2 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v3 |
| ef:activity/change/20260821T1122181958110000/133142 | context | ef:agent/default_context_mapping | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v3 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v4 |
| ef:activity/change/20260821T1122181958110000/133143 | context_iri | ef:agent/default_context_mapping | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v4 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v5 |
| ef:activity/change/20260821T1122181958110000/215077 | unit_iri | ef:agent/unit_normalization | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v5 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v6 |
| ef:activity/change/20260821T1122181958110000/222293 | prefLabel | ef:agent/normalize_name_case | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v6 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v7 |
| ef:activity/change/20260821T1122181958110000/232182 | properties | ef:agent/enrich_references | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v7 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v8 |
| ef:activity/change/20260821T1122181958110000/232183 | skos_definition | ef:agent/enrich_references | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v8 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v9 |
| ef:activity/change/20260821T1122181958110000/232184 | references | ef:agent/enrich_references | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v9 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v10 |
| ef:activity/change/20260821T1122181958110000/249752 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v10 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v11 |
| ef:activity/change/20260821T1122181958110000/261880 | altLabel | ef:agent/consensus_match | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v11 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v12 |
| ef:activity/change/20260821T1122181958110000/261881 | cas_match_labels | ef:agent/consensus_match | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v12 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v13 |
| ef:activity/change/20260821T1122181958110000/274889 | properties | ef:agent/opsin_iupac | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v13 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v14 |
| ef:activity/change/20260821T1122181958110000/281364 | properties | ef:agent/rdkit_post_consensus | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v14 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v15 |
| ef:activity/change/20260821T1122181958110000/288320 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v15 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v16 |
| ef:activity/change/20260821T1122181958110000/347564 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v16 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v17 |
| ef:activity/change/20260821T1122181958110000/389196 | properties | ef:agent/normalise_property_values | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v17 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v18 |
| ef:activity/change/20260821T1122181958110000/396243 | types | ef:agent/link_flows_to_their_substance | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v18 | ef:flow/8c0f0fe6-8576-4f14-892e-75c97cfdc0e0/v19 |