Iron(3+) Trinitrate
Everything that changed this flow. Back to the flow
580a5127-1a89-44fa-b58a-babc2cd6c64b
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, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'FN 376' (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=iron(3+)trinitrate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'10421-48-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4b588d2c128cda7e: {'10421-48-4': '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=['10421-48-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[25251, 16211566, 25203911]; selected_pubchem_cids=[25251, 25203911]; 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 |
|---|---|---|---|---|---|
| 3,212 | bootstrap_labels | prefLabel | — | [{"@value":"iron(3+) trinitrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 3,213 | bootstrap_labels | name | iron(3+) trinitrate | — | Purged legacy name field to enforce prefLabel usage |
| 3,214 | bootstrap_labels | synonyms | ["inorganic","irontrinitrate","ferricnitrate9.5%solution","ferricnitrate,technical"] | [] | Removed legacy synonyms field in favor of structured labels |
| 102,096 | 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 |
| 102,097 | 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 |
| 214,411 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,825 | normalize_name_case | prefLabel | [{"@value":"iron(3+) trinitrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | [{"@value":"Iron(3+) Trinitrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 230,269 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 230,270 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 230,271 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.030.805","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['10421-48-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[25251, 16211566, 25203911]; selected_pubchem_cids=[25251, 25203911]; 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 |
| 249,212 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | rdkit_pre_consensus from '[N+](=O)(O)[O-].[N+](=O)(O)[O-].[N+](=O)(O)[O-].[Fe]'; added: molecular_formula, molecular_mass, monoisotopic_mass |
| 268,046 | consensus_match | altLabel | [] | [{"@value":"Anaerite 263Hi","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | group_key=iron(3+)trinitrate||dimension=Environmental > media=Ground > geography=Unknown; cas=10421-48-4; added Common Chemistry CAS names as altLabel: Anaerite 263Hi, FN 376, Ferric nitrate, Gazhazot, Iron nitrate (Fe(NO<sub>3</sub>)<sub>3</sub>), Iron trinitrate, Iron(III) nitrate, Nitric acid, iron(3+) salt, Nitric acid, iron(3+) salt (3:1); object_uuid=fo-4b588d2c128cda7e |
| 268,047 | consensus_match | cas_match_labels | — | {"10421-48-4":"exactMatch"} | group_key=iron(3+)trinitrate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'10421-48-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4b588d2c128cda7e: {'10421-48-4': 'exactMatch'} |
| 274,327 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Iron(3+) Trinitrate' |
| 280,760 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | rdkit_post_consensus from 'O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Fe+3]'; added: molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula |
| 286,782 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["FeH3N3O9",… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 287,894 | strip_catalogue_altlabels | altLabel | [{"@value":"Anaerite 263Hi","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | [{"@value":"Anaerite 263Hi","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | Removed 1 catalogue altLabel value(s): 'FN 376' (grade code) |
| 332,045 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/580a5127-1a89-… | associations resolved on the elementary layer |
| 395,437 | 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/20260822T0600486828500000/3212 | prefLabel | ef:agent/bootstrap_labels | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v0 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v1 |
| ef:activity/change/20260822T0600486828500000/3213 | name | ef:agent/bootstrap_labels | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v1 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v2 |
| ef:activity/change/20260822T0600486828500000/3214 | synonyms | ef:agent/bootstrap_labels | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v2 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v3 |
| ef:activity/change/20260822T0600486828500000/102096 | context | ef:agent/default_context_mapping | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v3 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v4 |
| ef:activity/change/20260822T0600486828500000/102097 | context_iri | ef:agent/default_context_mapping | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v4 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v5 |
| ef:activity/change/20260822T0600486828500000/214411 | unit_iri | ef:agent/unit_normalization | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v5 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v6 |
| ef:activity/change/20260822T0600486828500000/221825 | prefLabel | ef:agent/normalize_name_case | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v6 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v7 |
| ef:activity/change/20260822T0600486828500000/230269 | properties | ef:agent/enrich_references | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v7 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v8 |
| ef:activity/change/20260822T0600486828500000/230270 | skos_definition | ef:agent/enrich_references | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v8 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v9 |
| ef:activity/change/20260822T0600486828500000/230271 | references | ef:agent/enrich_references | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v9 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v10 |
| ef:activity/change/20260822T0600486828500000/249212 | properties | ef:agent/rdkit_pre_consensus | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v10 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v11 |
| ef:activity/change/20260822T0600486828500000/268046 | altLabel | ef:agent/consensus_match | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v11 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v12 |
| ef:activity/change/20260822T0600486828500000/268047 | cas_match_labels | ef:agent/consensus_match | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v12 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v13 |
| ef:activity/change/20260822T0600486828500000/274327 | properties | ef:agent/opsin_iupac | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v13 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v14 |
| ef:activity/change/20260822T0600486828500000/280760 | properties | ef:agent/rdkit_post_consensus | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v14 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v15 |
| ef:activity/change/20260822T0600486828500000/286782 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v15 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v16 |
| ef:activity/change/20260822T0600486828500000/287894 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v16 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v17 |
| ef:activity/change/20260822T0600486828500000/332045 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v17 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v18 |
| ef:activity/change/20260822T0600486828500000/395437 | types | ef:agent/link_flows_to_their_substance | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v18 | ef:flow/580a5127-1a89-44fa-b58a-babc2cd6c64b/v19 |