Metronidazole
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-6fb03113f50a3a1e
Changes
58| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 6,855 | bootstrap_labels | prefLabel | — | [{"@value":"metronidazole","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"… | Bootstrapped prefLabel from legacy name field |
| 6,856 | bootstrap_labels | name | metronidazole | — | Purged legacy name field to enforce prefLabel usage |
| 6,857 | bootstrap_labels | synonyms | ["1-(.beta.-Ethylol)-2-methyl-5-nitro-3-azapyrrole","1-(.beta.-Hydroxyethyl)-2-methyl-5-nitroimidazole","1-(2-Hydroxy-1… | [] | Removed legacy synonyms field in favor of structured labels |
| 24,942 | bootstrap_labels | synonyms | ["metronidazole","1h-imidazole-1-ethanol,2-methyl-5-nitro-","2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethan-1-ol","2-(2-met… | [] | Removed legacy synonyms field in favor of structured labels |
| 32,468 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 32,469 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 32,470 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 32,471 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 32,472 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 32,473 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 32,474 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 32,475 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 33,900 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 33,901 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 33,902 | 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 |
| 33,903 | 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 |
| 33,904 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 33,905 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 33,906 | 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 |
| 33,907 | 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 |
| 37,446 | 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 |
| 37,447 | 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 |
| 37,448 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 37,449 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 37,450 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 37,451 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 44,638 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 44,639 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 161,152 | 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 |
| 161,153 | 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 |
| 215,627 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,668 | normalize_name_case | prefLabel | [{"@value":"metronidazole","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"… | [{"@value":"Metronidazole","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,758 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 233,759 | enrich_references | skos_definition | — | [{"@value":"A member of the class of imidazoles substituted at C-1, -2 and -5 with 2-hydroxyethyl, nitro and methyl gro… | Merged ChEBI/PubChem definitions into skos:definition |
| 233,760 | enrich_references | references | [] | [{"@id":"drugcentral:1790","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['443-48-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_6909']; candidate_pubchem_cids=[4173, 69715]; selected_pubchem_cids=[4173]; 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 |
| 250,213 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | rdkit_pre_consensus from 'CC1=NC=C(N1CCO)[N+](=O)[O-]'; added: monoisotopic_mass |
| 255,229 | chebi_altlabels | altLabel | [] | [{"@value":"1-(2-hydroxy-1-ethyl)-2-methyl-5-nitroimidazole","@language":"en","source":{"prov:wasGeneratedBy":"chebi_al… | Added 11 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 269,008 | consensus_match | altLabel | [{"@value":"1-(2-hydroxy-1-ethyl)-2-methyl-5-nitroimidazole","@language":"en","source":{"prov:wasGeneratedBy":"chebi_al… | [{"@value":"1-(2-hydroxy-1-ethyl)-2-methyl-5-nitroimidazole","@language":"en","source":{"prov:wasGeneratedBy":"chebi_al… | group_key=metronidazole||dimension=Environmental > media=Water > water_body=Long-term; cas=443-48-1; added Common Chemistry CAS names as altLabel: 1-(β-Hydroxyethyl)-2-methyl-5-nitroimidazole, 1-Hydroxyethyl-2-methyl-5-nitroimidazole, 1<em>H</em>-Imidazole-1-ethanol, 2-methyl-5-nitro-, 2-(2-Methyl-5-nitro-1<em>H</em>-imidazol-1-yl)ethan-1-ol, 2-Methyl-5-nitro-1<em>H</em>-imidazole-1-ethanol, Amrizole, Anagiardil, Arilin, Bayer 5360, Cimetrol 500LPCI, Clont, Compeba, Deflamon, Dentamet gel, Efloran, Elyzol, Emgyl, Emtrin, Entizol, Flagesol, Flagil, Flagyl, Flazol, Fossyol, Gineflavir, Imidazole-1-ethanol, 2-methyl-5-nitro-, Klion, Klont, Loxagyl, MeSH ID: D008795, Medazol, Metro, Metro Cream & Gel, MetroGel, Metrodine, Metrodol, Metrogyl, Metrolag, Metrolyl, Metron, Metropol, Metrotab, Metrotop, Mexibol, NSC 50364, NSC 69587, Nidazole, Noritate, Orvagil, Polibiotic, Protostat, RP 8823, Rathimed, Rosiced, Sanatrichom, Satric, Supplin, Takimetol, Trichazol, Tricho Cordes, Tricho-Gynaedron, Trichobrol, Trichocide, Trichomol, Trichopal, Trichopol, Trichopole, Trichozole, Tricocet, Trikhopol, Trivazol, Tromet, Vagilen, Vagimid, Zadstat, metrovagin; object_uuid=fo-6fb03113f50a3a1e |
| 269,009 | consensus_match | cas_match_labels | — | {"443-48-1":"exactMatch"} | group_key=metronidazole||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'443-48-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fb03113f50a3a1e: {'443-48-1': 'exactMatch'} |
| 275,355 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-(2-hydroxy-1-ethyl)-2-methyl-5-nitroimidazole' |
| 281,865 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H9N3O3"]… | rdkit_post_consensus from 'Cc1ncc([N+](=O)[O-])n1CCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,655 | strip_catalogue_altlabels | altLabel | [{"@value":"1-(2-hydroxy-1-ethyl)-2-methyl-5-nitroimidazole","@language":"en","source":{"prov:wasGeneratedBy":"chebi_al… | [{"@value":"1-(2-hydroxy-1-ethyl)-2-methyl-5-nitroimidazole","@language":"en","source":{"prov:wasGeneratedBy":"chebi_al… | Removed 4 catalogue altLabel value(s): 'Bayer 5360' (trade name), 'NSC 50364' (registry code), 'NSC 69587' (registry code), 'RP 8823' (grade code) |
| 297,273 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,274 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,275 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,276 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,984 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,985 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,986 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 297,987 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |