Methyl N-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate
Everything that changed this flow. Back to the flow
2879ae22-7687-4ed5-826b-86d3b21d8c35
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=methyln-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=[]; cas_sources={'149850-30-6': []}; assigned CAS labels from group consensus; object_uuid=fo-64f2cf72a486ecb3: {'149850-30-6': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['149850-30-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[3956112, 57348669]; selected_pubchem_cids=[57348669]; 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 |
|---|---|---|---|---|---|
| 13,219 | bootstrap_labels | prefLabel | — | [{"@value":"methyl n-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate","@language… | Bootstrapped prefLabel from legacy name field |
| 13,220 | bootstrap_labels | name | methyl n-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate | — | Purged legacy name field to enforce prefLabel usage |
| 13,221 | bootstrap_labels | synonyms | ["organic","methyln-[3-acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-[(1-methoxy)acetyl]glycinate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 63,076 | 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 |
| 63,077 | 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 |
| 217,708 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,156 | normalize_name_case | prefLabel | [{"@value":"methyl n-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate","@language… | [{"@value":"Methyl N-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate","@language… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,714 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,715 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,716 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.644.347F","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['149850-30-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[3956112, 57348669]; selected_pubchem_cids=[57348669]; 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 |
| 251,920 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | rdkit_pre_consensus from 'CC(=O)NC1=C(C=CC(=C1)N(CC(=O)OC)CC(=O)OC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N'; added: molecular_mass, monoisotopic_mass |
| 268,891 | consensus_match | altLabel | [] | [{"@value":"<em>N</em>-[3-(Acetylamino)-4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-<em>N</em>-(2-methoxy-2-oxoethyl)g… | group_key=methyln-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate||dimension=Environmental > media=Water > water_body=Surface water; cas=149850-30-6; added Common Chemistry CAS names as altLabel: <em>N</em>-[3-(Acetylamino)-4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-<em>N</em>-(2-methoxy-2-oxoethyl)glycine methyl ester, Bemacron Red HP-LTD 01, Disperse Red 4BS, Disperse Rubine HWF, Glycine, <em>N</em>-[3-(acetylamino)-4-[(2-cyano-4-nitrophenyl)azo]phenyl]-<em>N</em>-(2-methoxy-2-oxoethyl)-, methyl ester, Glycine, <em>N</em>-[3-(acetylamino)-4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-<em>N</em>-(2-methoxy-2-oxoethyl)-, methyl ester; object_uuid=fo-64f2cf72a486ecb3 |
| 268,892 | consensus_match | cas_match_labels | — | {"149850-30-6":"exactMatch"} | group_key=methyln-[3-(acetylamino)-4-(2-cyano-4-nitrophenylazo)phenyl]-n-(2-methoxy-2-oxoethyl)glycinate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=[]; cas_sources={'149850-30-6': []}; assigned CAS labels from group consensus; object_uuid=fo-64f2cf72a486ecb3: {'149850-30-6': 'exactMatch'} |
| 277,115 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'N-[3-(Acetylamino)-4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-N-(2-methoxy-2-oxoethyl)glycine methyl ester' |
| 283,775 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | rdkit_post_consensus from 'COC(=O)CN(CC(=O)OC)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2C#N)c(NC(C)=O)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,678 | dedupe_altlabels | altLabel | [{"@value":"<em>N</em>-[3-(Acetylamino)-4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-<em>N</em>-(2-methoxy-2-oxoethyl)g… | [{"@value":"N-[3-(Acetylamino)-4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-N-(2-methoxy-2-oxoethyl)glycine methyl este… | Deduplicated altLabel values and removed entries matching prefLabel |
| 312,556 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2879ae22-7687-… | associations resolved on the elementary layer |
| 391,465 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H20N6O7… | typed the way the ontology types it |
| 399,510 | 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/20260822T0600486828500000/13219 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v0 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v1 |
| ef:activity/change/20260822T0600486828500000/13220 | name | ef:agent/bootstrap_labels | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v1 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v2 |
| ef:activity/change/20260822T0600486828500000/13221 | synonyms | ef:agent/bootstrap_labels | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v2 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v3 |
| ef:activity/change/20260822T0600486828500000/63076 | context | ef:agent/default_context_mapping | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v3 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v4 |
| ef:activity/change/20260822T0600486828500000/63077 | context_iri | ef:agent/default_context_mapping | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v4 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v5 |
| ef:activity/change/20260822T0600486828500000/217708 | unit_iri | ef:agent/unit_normalization | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v5 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v6 |
| ef:activity/change/20260822T0600486828500000/224156 | prefLabel | ef:agent/normalize_name_case | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v6 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v7 |
| ef:activity/change/20260822T0600486828500000/239714 | properties | ef:agent/enrich_references | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v7 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v8 |
| ef:activity/change/20260822T0600486828500000/239715 | skos_definition | ef:agent/enrich_references | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v8 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v9 |
| ef:activity/change/20260822T0600486828500000/239716 | references | ef:agent/enrich_references | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v9 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v10 |
| ef:activity/change/20260822T0600486828500000/251920 | properties | ef:agent/rdkit_pre_consensus | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v10 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v11 |
| ef:activity/change/20260822T0600486828500000/268891 | altLabel | ef:agent/consensus_match | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v11 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v12 |
| ef:activity/change/20260822T0600486828500000/268892 | cas_match_labels | ef:agent/consensus_match | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v12 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v13 |
| ef:activity/change/20260822T0600486828500000/277115 | properties | ef:agent/opsin_iupac | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v13 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v14 |
| ef:activity/change/20260822T0600486828500000/283775 | properties | ef:agent/rdkit_post_consensus | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v14 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v15 |
| ef:activity/change/20260822T0600486828500000/292678 | altLabel | ef:agent/dedupe_altlabels | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v15 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v16 |
| ef:activity/change/20260822T0600486828500000/312556 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v16 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v17 |
| ef:activity/change/20260822T0600486828500000/391465 | properties | ef:agent/normalise_property_values | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v17 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v18 |
| ef:activity/change/20260822T0600486828500000/399510 | types | ef:agent/link_flows_to_their_substance | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v18 | ef:flow/2879ae22-7687-4ed5-826b-86d3b21d8c35/v19 |