3-nitrophenol
Everything that changed this flow. Back to the flow
0c4a6dab-cb0d-414d-8e56-1a728d0d526c
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 1551' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=3-nitrophenol||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'554-84-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-13ce49aeb711d185: {'554-84-7': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 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=['554-84-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_34346']; candidate_pubchem_cids=[11137]; selected_pubchem_cids=[11137]; 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 |
|---|---|---|---|---|---|
| 3,131 | bootstrap_labels | prefLabel | — | [{"@value":"3-nitrophenol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"… | Bootstrapped prefLabel from legacy name field |
| 3,132 | bootstrap_labels | name | 3-nitrophenol | — | Purged legacy name field to enforce prefLabel usage |
| 3,133 | bootstrap_labels | synonyms | ["1-Hydroxy-3-nitrobenzene","3-Hydroxynitrobenzene","AB1002331","AC-3123","AC1L1WOY","AKOS000119831","CPD-9127","Crump… | [] | Removed legacy synonyms field in favor of structured labels |
| 43,728 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 43,729 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 214,384 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 230,189 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 230,190 | enrich_references | skos_definition | — | [{"@value":"A member of the class of 3-nitrophenols that is phenol in which one of the hydrogens that is meta to the hy… | Merged ChEBI/PubChem definitions into skos:definition |
| 230,191 | enrich_references | references | [] | [{"@id":"gmelin:3293","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"conse… | Added references with provenance; cas_numbers=['554-84-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_34346']; candidate_pubchem_cids=[11137]; selected_pubchem_cids=[11137]; 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 |
| 249,188 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)O)[N+](=O)[O-]'; added: monoisotopic_mass |
| 254,740 | chebi_altlabels | altLabel | [] | [{"@value":"1-hydroxy-3-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 262,164 | consensus_match | altLabel | [{"@value":"1-hydroxy-3-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | [{"@value":"1-hydroxy-3-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | group_key=3-nitrophenol||dimension=Environmental > media=Water > water_body=Ocean; cas=554-84-7; added Common Chemistry CAS names as altLabel: NSC 1551, Phenol, 3-nitro-, Phenol, <em>m</em>-nitro-; object_uuid=fo-13ce49aeb711d185 |
| 262,165 | consensus_match | cas_match_labels | — | {"554-84-7":"exactMatch"} | group_key=3-nitrophenol||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'554-84-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-13ce49aeb711d185: {'554-84-7': 'exactMatch'} |
| 274,300 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-nitrophenol' |
| 280,732 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | rdkit_post_consensus from 'O=[N+]([O-])c1cccc(O)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,871 | strip_catalogue_altlabels | altLabel | [{"@value":"1-hydroxy-3-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | [{"@value":"1-hydroxy-3-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | Removed 1 catalogue altLabel value(s): 'NSC 1551' (registry code) |
| 302,888 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0c4a6dab-cb0d-… | associations resolved on the elementary layer |
| 388,598 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5NO3"],… | typed the way the ontology types it |
| 395,404 | 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/20260821T1122181958110000/3131 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v0 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v1 |
| ef:activity/change/20260821T1122181958110000/3132 | name | ef:agent/bootstrap_labels | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v1 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v2 |
| ef:activity/change/20260821T1122181958110000/3133 | synonyms | ef:agent/bootstrap_labels | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v2 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v3 |
| ef:activity/change/20260821T1122181958110000/43728 | context | ef:agent/default_context_mapping | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v3 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v4 |
| ef:activity/change/20260821T1122181958110000/43729 | context_iri | ef:agent/default_context_mapping | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v4 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v5 |
| ef:activity/change/20260821T1122181958110000/214384 | unit_iri | ef:agent/unit_normalization | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v5 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v6 |
| ef:activity/change/20260821T1122181958110000/230189 | properties | ef:agent/enrich_references | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v6 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v7 |
| ef:activity/change/20260821T1122181958110000/230190 | skos_definition | ef:agent/enrich_references | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v7 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v8 |
| ef:activity/change/20260821T1122181958110000/230191 | references | ef:agent/enrich_references | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v8 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v9 |
| ef:activity/change/20260821T1122181958110000/249188 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v9 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v10 |
| ef:activity/change/20260821T1122181958110000/254740 | altLabel | ef:agent/chebi_altlabels | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v10 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v11 |
| ef:activity/change/20260821T1122181958110000/262164 | altLabel | ef:agent/consensus_match | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v11 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v12 |
| ef:activity/change/20260821T1122181958110000/262165 | cas_match_labels | ef:agent/consensus_match | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v12 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v13 |
| ef:activity/change/20260821T1122181958110000/274300 | properties | ef:agent/opsin_iupac | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v13 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v14 |
| ef:activity/change/20260821T1122181958110000/280732 | properties | ef:agent/rdkit_post_consensus | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v14 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v15 |
| ef:activity/change/20260821T1122181958110000/287871 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v15 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v16 |
| ef:activity/change/20260821T1122181958110000/302888 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v16 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v17 |
| ef:activity/change/20260821T1122181958110000/388598 | properties | ef:agent/normalise_property_values | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v17 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v18 |
| ef:activity/change/20260821T1122181958110000/395404 | types | ef:agent/link_flows_to_their_substance | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v18 | ef:flow/0c4a6dab-cb0d-414d-8e56-1a728d0d526c/v19 |