5-Nitrosalicylic acid
Everything that changed this flow. Back to the flow
118c9520-fd74-41f7-89f5-2bf71e2ad7d7
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 175998' (registry code), 'NSC 183' (registry code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=96-97-9; cc_chebi_agreed_name='5-Nitrosalicylic acid'; object_uuid=fo-40c87ea61cc056fa |
| cas_match_labels | 1 | consensus_match | group_key=2-hydroxy-5-nitrobenzoicacid||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'96-97-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-40c87ea61cc056fa: {'96-97-9': '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=['96-97-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_61281']; candidate_pubchem_cids=[7318, 99348, 6992157, 19627166]; selected_pubchem_cids=[7318]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,912 | bootstrap_labels | prefLabel | — | [{"@value":"2-hydroxy-5-nitrobenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Bootstrapped prefLabel from legacy name field |
| 9,913 | bootstrap_labels | name | 2-hydroxy-5-nitrobenzoic acid | — | Purged legacy name field to enforce prefLabel usage |
| 9,914 | bootstrap_labels | synonyms | ["organic","5-nitrosalicylicacid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 47,704 | 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 |
| 47,705 | 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 |
| 216,632 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,411 | normalize_name_case | prefLabel | [{"@value":"2-hydroxy-5-nitrobenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | [{"@value":"2-hydroxy-5-nitrobenzoic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,646 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 236,647 | enrich_references | skos_definition | — | [{"@value":"A monohydroxybenzoic acid in which the hydroxy group is ortho- to the carboxylic acid group and which has a… | Merged ChEBI/PubChem definitions into skos:definition |
| 236,648 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J26.976J","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['96-97-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_61281']; candidate_pubchem_cids=[7318, 99348, 6992157, 19627166]; selected_pubchem_cids=[7318]; 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 |
| 251,039 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | rdkit_pre_consensus from 'C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)O'; added: monoisotopic_mass |
| 255,796 | chebi_altlabels | altLabel | [] | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 260,919 | consensus_match | prefLabel | [{"@value":"2-hydroxy-5-nitrobenzoic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | [{"@value":"5-Nitrosalicylic acid","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | cas=96-97-9; cc_chebi_agreed_name='5-Nitrosalicylic acid'; object_uuid=fo-40c87ea61cc056fa |
| 260,920 | consensus_match | altLabel | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | cas=96-97-9; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-40c87ea61cc056fa |
| 260,921 | consensus_match | altLabel | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | group_key=2-hydroxy-5-nitrobenzoicacid||dimension=Environmental > media=Air > strata=Unknown; cas=96-97-9; added Common Chemistry CAS names as altLabel: Benzoic acid, 2-hydroxy-5-nitro-, NSC 175998, NSC 183, Salicylic acid, 5-nitro-; object_uuid=fo-40c87ea61cc056fa |
| 260,922 | consensus_match | cas_match_labels | — | {"96-97-9":"exactMatch"} | group_key=2-hydroxy-5-nitrobenzoicacid||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'96-97-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-40c87ea61cc056fa: {'96-97-9': 'exactMatch'} |
| 276,225 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '5-Nitrosalicylic acid' |
| 282,810 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | rdkit_post_consensus from 'O=C(O)c1cc([N+](=O)[O-])ccc1O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,330 | strip_catalogue_altlabels | altLabel | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"5-nitro-2-hydroxybenzoic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | Removed 2 catalogue altLabel value(s): 'NSC 175998' (registry code), 'NSC 183' (registry code) |
| 304,880 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/118c9520-fd74-… | associations resolved on the elementary layer |
| 390,571 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5NO5"],… | typed the way the ontology types it |
| 398,234 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260821T1554374006150000/9912 | prefLabel | ef:agent/bootstrap_labels | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v0 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v1 |
| ef:activity/change/20260821T1554374006150000/9913 | name | ef:agent/bootstrap_labels | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v1 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v2 |
| ef:activity/change/20260821T1554374006150000/9914 | synonyms | ef:agent/bootstrap_labels | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v2 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v3 |
| ef:activity/change/20260821T1554374006150000/47704 | context | ef:agent/default_context_mapping | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v3 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v4 |
| ef:activity/change/20260821T1554374006150000/47705 | context_iri | ef:agent/default_context_mapping | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v4 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v5 |
| ef:activity/change/20260821T1554374006150000/216632 | unit_iri | ef:agent/unit_normalization | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v5 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v6 |
| ef:activity/change/20260821T1554374006150000/223411 | prefLabel | ef:agent/normalize_name_case | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v6 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v7 |
| ef:activity/change/20260821T1554374006150000/236646 | properties | ef:agent/enrich_references | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v7 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v8 |
| ef:activity/change/20260821T1554374006150000/236647 | skos_definition | ef:agent/enrich_references | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v8 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v9 |
| ef:activity/change/20260821T1554374006150000/236648 | references | ef:agent/enrich_references | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v9 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v10 |
| ef:activity/change/20260821T1554374006150000/251039 | properties | ef:agent/rdkit_pre_consensus | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v10 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v11 |
| ef:activity/change/20260821T1554374006150000/255796 | altLabel | ef:agent/chebi_altlabels | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v11 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v12 |
| ef:activity/change/20260821T1554374006150000/260919 | prefLabel | ef:agent/consensus_match | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v12 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v13 |
| ef:activity/change/20260821T1554374006150000/260920 | altLabel | ef:agent/consensus_match | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v13 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v14 |
| ef:activity/change/20260821T1554374006150000/260921 | altLabel | ef:agent/consensus_match | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v14 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v15 |
| ef:activity/change/20260821T1554374006150000/260922 | cas_match_labels | ef:agent/consensus_match | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v15 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v16 |
| ef:activity/change/20260821T1554374006150000/276225 | properties | ef:agent/opsin_iupac | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v16 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v17 |
| ef:activity/change/20260821T1554374006150000/282810 | properties | ef:agent/rdkit_post_consensus | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v17 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v18 |
| ef:activity/change/20260821T1554374006150000/289330 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v18 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v19 |
| ef:activity/change/20260821T1554374006150000/304880 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v19 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v20 |
| ef:activity/change/20260821T1554374006150000/390571 | properties | ef:agent/normalise_property_values | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v20 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v21 |
| ef:activity/change/20260821T1554374006150000/398234 | types | ef:agent/link_flows_to_their_substance | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v21 | ef:flow/118c9520-fd74-41f7-89f5-2bf71e2ad7d7/v22 |