2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate
Everything that changed this flow. Back to the flow
841c8c68-aa1b-4daf-b4d3-ab323f37d337
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'C.I. 20055' (registry code), 'PR 220' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=2-chloroethyl2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory']; cas_sources={'68259-05-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-8c27084215b2bd46: {'68259-05-2': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['68259-05-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[109944, 135853568]; selected_pubchem_cids=[135853568]; 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 |
|---|---|---|---|---|---|
| 2,761 | bootstrap_labels | prefLabel | — | [{"@value":"2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxon… | Bootstrapped prefLabel from legacy name field |
| 2,762 | bootstrap_labels | name | 2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2… | — | Purged legacy name field to enforce prefLabel usage |
| 2,763 | bootstrap_labels | synonyms | ["organic","bis(2-chloroethyl)3,3'","-[(2,5-dimethyl-p-phenylene)bis[iminocarbonyl(2-hydroxy-1,3-naphthylene)azo]]d… | [] | Removed legacy synonyms field in favor of structured labels |
| 128,358 | 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 |
| 128,359 | 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 |
| 214,260 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 229,834 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,835 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,836 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J289.106I","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['68259-05-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[109944, 135853568]; selected_pubchem_cids=[135853568]; 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 |
| 249,083 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | rdkit_pre_consensus from 'CC1=C(C=C(C=C1)C(=O)OCCCl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC(=C(C=C4C)NC(=O)C5=CC6=CC=CC=C6C(=C5O)N=NC7=C(C=CC(=C7)C(=O)OCCCl)C)C)O'; added: molecular_mass, monoisotopic_mass |
| 260,714 | consensus_match | altLabel | [] | [{"@value":"Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazen… | group_key=2-chloroethyl2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=68259-05-2; added Common Chemistry CAS names as altLabel: Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazenediyl]]bis[4-methyl-, 1,1′-bis(2-chloroethyl) ester, Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)azo]]bis[4-methyl-, bis(2-chloroethyl) ester, C.I. 20055, C.I. Pigment Red 220, Cromophtal Red D 3830, Cromophtal Red G, Cromophtal Red K 3830, DTXSIDO0887313, PR 220, Pigment Red 220, Red K 3830; object_uuid=fo-8c27084215b2bd46 |
| 260,715 | consensus_match | cas_match_labels | — | {"68259-05-2":"exactMatch"} | group_key=2-chloroethyl2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory']; cas_sources={'68259-05-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-8c27084215b2bd46: {'68259-05-2': 'exactMatch'} |
| 274,200 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-chloroethyl 2-[(2z)-2-[3-[[4-[[(4e)-4-[[5-(2-chloroethoxycarbonyl)-2-methylphenyl]hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]-2,5-dimethylphenyl]carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-3-methylbenzoate' |
| 280,622 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | rdkit_post_consensus from 'Cc1ccc(C(=O)OCCCl)cc1N/N=C1/C(=O)C(C(=O)Nc2cc(C)c(NC(=O)C3=Cc4ccccc4/C(=N/Nc4c(C)cccc4C(=O)OCCCl)C3=O)cc2C)=Cc2ccccc21'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,770 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 287,799 | strip_catalogue_altlabels | altLabel | [{"@value":"Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazen… | [{"@value":"Benzoic acid, 3,3′-[(2,5-dimethyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazen… | Removed 2 catalogue altLabel value(s): 'C.I. 20055' (registry code), 'PR 220' (grade code) |
| 345,179 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/841c8c68-aa1b-… | associations resolved on the elementary layer |
| 395,249 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 395,250 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C50H42Cl2N… | 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/20260821T1122181958110000/2761 | prefLabel | ef:agent/bootstrap_labels | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v0 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v1 |
| ef:activity/change/20260821T1122181958110000/2762 | name | ef:agent/bootstrap_labels | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v1 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v2 |
| ef:activity/change/20260821T1122181958110000/2763 | synonyms | ef:agent/bootstrap_labels | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v2 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v3 |
| ef:activity/change/20260821T1122181958110000/128358 | context | ef:agent/default_context_mapping | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v3 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v4 |
| ef:activity/change/20260821T1122181958110000/128359 | context_iri | ef:agent/default_context_mapping | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v4 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v5 |
| ef:activity/change/20260821T1122181958110000/214260 | unit_iri | ef:agent/unit_normalization | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v5 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v6 |
| ef:activity/change/20260821T1122181958110000/229834 | properties | ef:agent/enrich_references | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v6 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v7 |
| ef:activity/change/20260821T1122181958110000/229835 | skos_definition | ef:agent/enrich_references | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v7 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v8 |
| ef:activity/change/20260821T1122181958110000/229836 | references | ef:agent/enrich_references | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v8 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v9 |
| ef:activity/change/20260821T1122181958110000/249083 | properties | ef:agent/rdkit_pre_consensus | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v9 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v10 |
| ef:activity/change/20260821T1122181958110000/260714 | altLabel | ef:agent/consensus_match | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v10 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v11 |
| ef:activity/change/20260821T1122181958110000/260715 | cas_match_labels | ef:agent/consensus_match | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v11 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v12 |
| ef:activity/change/20260821T1122181958110000/274200 | properties | ef:agent/opsin_iupac | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v12 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v13 |
| ef:activity/change/20260821T1122181958110000/280622 | properties | ef:agent/rdkit_post_consensus | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v13 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v14 |
| ef:activity/change/20260821T1122181958110000/286770 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v14 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v15 |
| ef:activity/change/20260821T1122181958110000/287799 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v15 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v16 |
| ef:activity/change/20260821T1122181958110000/345179 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v16 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v17 |
| ef:activity/change/20260821T1122181958110000/395249 | types | ef:agent/link_flows_to_their_substance | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v17 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v18 |
| ef:activity/change/20260821T1122181958110000/395250 | properties | ef:agent/link_flows_to_their_substance | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v18 | ef:flow/841c8c68-aa1b-4daf-b4d3-ab323f37d337/v19 |