2-methoxy-4-nitroaniline
Everything that changed this flow. Back to the flow
1798776e-55dc-4fe8-ba7b-d98cb41c76ac
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 2 catalogue altLabel value(s): 'C.I. 37125' (registry code), 'NSC 4130' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=2-methoxy-4-nitroaniline||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'97-52-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ce702d0f992b34f6: {'97-52-9': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['97-52-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[7337, 124667, 21503245]; selected_pubchem_cids=[7337]; 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 |
|---|---|---|---|---|---|
| 15,667 | bootstrap_labels | prefLabel | — | [{"@value":"2-methoxy-4-nitroaniline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 15,668 | bootstrap_labels | name | 2-methoxy-4-nitroaniline | — | Purged legacy name field to enforce prefLabel usage |
| 15,669 | bootstrap_labels | synonyms | ["organic","4-nitro-o-anisidine","2-amino-1-methoxy-5-nitrobenzene","2-amino-5-nitroanisole","2-methoxy-4-nitroaniline"… | [] | Removed legacy synonyms field in favor of structured labels |
| 52,194 | 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 |
| 52,195 | 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 |
| 218,492 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,945 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,946 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,947 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J96.207D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['97-52-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[7337, 124667, 21503245]; selected_pubchem_cids=[7337]; 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 |
| 252,574 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | rdkit_pre_consensus from 'COC1=C(C=CC(=C1)[N+](=O)[O-])N'; added: molecular_mass, monoisotopic_mass |
| 260,995 | consensus_match | altLabel | [] | [{"@value":"1-Amino-2-methoxy-4-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | group_key=2-methoxy-4-nitroaniline||dimension=Environmental > media=Water > water_body=Surface water; cas=97-52-9; added Common Chemistry CAS names as altLabel: 1-Amino-2-methoxy-4-nitrobenzene, 2-Amino-1-methoxy-5-nitrobenzene, 2-Amino-5-nitroanisole, 2-Methoxy-4-nitrobenzenamine, 3-Methoxy-4-aminonitrobenzene, 3-Nitro-6-aminoanisole, 4-Amino-3-methoxynitrobenzene, 4-Nitro-2-methoxyaniline, 4-Nitro-6-methoxyaniline, 4-Nitro-<em>o</em>-anisidine, <em>o</em>-Anisidine, 4-nitro-, <em>o</em>-Methoxy-<em>p</em>-nitroaniline, <em>p</em>-Nitro-<em>o</em>-anisidine, Amarthol Fast Red B Base, Azoamine Pink O, Azoene Fast Red B Base, Benzenamine, 2-methoxy-4-nitro-, Brentamine Fast Red B Base, C.I. 37125, Dainichi Fast Red B Base, Daito Red Base B, Devol Red E, Diabase Red B, Fast Red 5NA Base, Fast Red B Base, Fast Red B-T Base, Fast Red Base B, Hiltonil Fast Red B Base, Kako Red B Base, Kayaku Red B Base, Mitsui Red B Base, NSC 4130, Naphthanil Red B Base, Naphtoelan Red B Base, PNOA, Red B Base, Red Base Ciba V, Red Base Irga V, Red Base NB, Sanyo Fast Red B Base, Shinnippon Fast Red B Base, Showa Fast Red B Base, Symulon Red B Base; object_uuid=fo-ce702d0f992b34f6 |
| 260,996 | consensus_match | cas_match_labels | — | {"97-52-9":"exactMatch"} | group_key=2-methoxy-4-nitroaniline||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'97-52-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ce702d0f992b34f6: {'97-52-9': 'exactMatch'} |
| 277,781 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-methoxy-4-nitroaniline' |
| 284,481 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | rdkit_post_consensus from 'COc1cc([N+](=O)[O-])ccc1N'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,448 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Amino-2-methoxy-4-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | [{"@value":"1-Amino-2-methoxy-4-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | Removed 2 catalogue altLabel value(s): 'C.I. 37125' (registry code), 'NSC 4130' (registry code) |
| 307,125 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1798776e-55dc-… | associations resolved on the elementary layer |
| 392,133 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2O3"]… | typed the way the ontology types it |
| 400,454 | 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/20260821T1302361922970000/15667 | prefLabel | ef:agent/bootstrap_labels | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v0 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v1 |
| ef:activity/change/20260821T1302361922970000/15668 | name | ef:agent/bootstrap_labels | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v1 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v2 |
| ef:activity/change/20260821T1302361922970000/15669 | synonyms | ef:agent/bootstrap_labels | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v2 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v3 |
| ef:activity/change/20260821T1302361922970000/52194 | context | ef:agent/default_context_mapping | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v3 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v4 |
| ef:activity/change/20260821T1302361922970000/52195 | context_iri | ef:agent/default_context_mapping | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v4 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v5 |
| ef:activity/change/20260821T1302361922970000/218492 | unit_iri | ef:agent/unit_normalization | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v5 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v6 |
| ef:activity/change/20260821T1302361922970000/241945 | properties | ef:agent/enrich_references | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v6 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v7 |
| ef:activity/change/20260821T1302361922970000/241946 | skos_definition | ef:agent/enrich_references | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v7 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v8 |
| ef:activity/change/20260821T1302361922970000/241947 | references | ef:agent/enrich_references | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v8 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v9 |
| ef:activity/change/20260821T1302361922970000/252574 | properties | ef:agent/rdkit_pre_consensus | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v9 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v10 |
| ef:activity/change/20260821T1302361922970000/260995 | altLabel | ef:agent/consensus_match | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v10 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v11 |
| ef:activity/change/20260821T1302361922970000/260996 | cas_match_labels | ef:agent/consensus_match | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v11 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v12 |
| ef:activity/change/20260821T1302361922970000/277781 | properties | ef:agent/opsin_iupac | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v12 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v13 |
| ef:activity/change/20260821T1302361922970000/284481 | properties | ef:agent/rdkit_post_consensus | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v13 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v14 |
| ef:activity/change/20260821T1302361922970000/290448 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v14 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v15 |
| ef:activity/change/20260821T1302361922970000/307125 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v15 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v16 |
| ef:activity/change/20260821T1302361922970000/392133 | properties | ef:agent/normalise_property_values | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v16 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v17 |
| ef:activity/change/20260821T1302361922970000/400454 | types | ef:agent/link_flows_to_their_substance | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v17 | ef:flow/1798776e-55dc-4fe8-ba7b-d98cb41c76ac/v18 |