N-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-ae393c0e71739d9e
Changes
55| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 982 | bootstrap_labels | prefLabel | — | [{"@value":"n-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine","@language":"en","source":{"prov:wasGeneratedBy":"boot… | Bootstrapped prefLabel from legacy name field |
| 983 | bootstrap_labels | name | n-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine | — | Purged legacy name field to enforce prefLabel usage |
| 984 | bootstrap_labels | synonyms | ["organic","1,2-ethanediamine,n1-[(6-chloro-3-pyridinyl)methyl]-"] | [] | Removed legacy synonyms field in favor of structured labels |
| 26,575 | 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 |
| 26,576 | 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 |
| 43,669 | 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 |
| 43,670 | 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 |
| 58,335 | 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 |
| 58,336 | 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 |
| 60,179 | 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 |
| 60,180 | 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 |
| 72,463 | 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) |
| 72,464 | 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) |
| 84,811 | 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 |
| 84,812 | 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 |
| 102,561 | 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 |
| 102,562 | 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 |
| 106,981 | 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 |
| 106,982 | 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 |
| 127,275 | 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 |
| 127,276 | 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 |
| 135,743 | 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 |
| 135,744 | 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 |
| 151,293 | 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 |
| 151,294 | 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 |
| 155,523 | 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 |
| 155,524 | 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 |
| 196,079 | 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) |
| 196,080 | 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) |
| 213,665 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,324 | normalize_name_case | prefLabel | [{"@value":"n-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine","@language":"en","source":{"prov:wasGeneratedBy":"boot… | [{"@value":"N-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine","@language":"en","source":{"prov:wasGeneratedBy":"boot… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,116 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,117 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,118 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J900.587K","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['101990-44-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[10997737]; selected_pubchem_cids=[10997737]; 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 |
| 248,589 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | rdkit_pre_consensus from 'C1=CC(=NC=C1CNCCN)Cl'; added: molecular_mass, monoisotopic_mass |
| 269,418 | consensus_match | altLabel | [] | [{"@value":"(2-Aminoethyl)[(6-chloropyridin-3-yl)methyl]amine","@language":"en","source":{"prov:wasGeneratedBy":"consen… | group_key=n-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine||dimension=Environmental > media=Water > water_body=Unknown; cas=101990-44-7; added Common Chemistry CAS names as altLabel: (2-Aminoethyl)[(6-chloropyridin-3-yl)methyl]amine, 1,2-Ethanediamine, <em>N</em>-[(6-chloro-3-pyridinyl)methyl]-, 1,2-Ethanediamine, <em>N</em><sup>1</sup>-[(6-chloro-3-pyridinyl)methyl]-, 2-(6-Chloro-3-pyridylmethylamino)ethylamine, 2-Chloro-5-((2-aminoethyl)aminomethyl)pyridine, 5-(2-Aminoethylaminomethyl)-2-chloropyridine, <em>N</em>-(2-Chloro-5-pyridylmethyl)ethylenediamine, <em>N</em>-(6-Chloro-3-pyridylmethyl)ethylenediamine, <em>N</em>-[(6-Chloropyridin-3-yl)methyl]ethane-1,2-diamine, <em>N</em><sup>1</sup>-[(6-Chloro-3-pyridinyl)methyl]-1,2-ethanediamine; object_uuid=fo-ae393c0e71739d9e |
| 269,419 | consensus_match | cas_match_labels | — | {"101990-44-7":"exactMatch"} | group_key=n-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'101990-44-7': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ae393c0e71739d9e: {'101990-44-7': 'exactMatch'} |
| 273,712 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'N-[(6-chloro-3-pyridinyl)methyl]-1,2-ethane-diamine' |
| 280,089 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H12ClN3"… | rdkit_post_consensus from 'NCCNCc1ccc(Cl)nc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,011 | dedupe_altlabels | altLabel | [{"@value":"(2-Aminoethyl)[(6-chloropyridin-3-yl)methyl]amine","@language":"en","source":{"prov:wasGeneratedBy":"consen… | [{"@value":"(2-Aminoethyl)[(6-chloropyridin-3-yl)methyl]amine","@language":"en","source":{"prov:wasGeneratedBy":"consen… | Deduplicated altLabel values and removed entries matching prefLabel |
| 294,370 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/011daa2c-c91a-… | associations resolved on the elementary layer |
| 302,899 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0c3384cf-0324-… | associations resolved on the elementary layer |
| 310,228 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/204913ec-7c1c-… | associations resolved on the elementary layer |
| 311,147 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/23690f27-2e02-… | associations resolved on the elementary layer |
| 317,286 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/357f5732-3a99-… | associations resolved on the elementary layer |
| 323,458 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/493cac28-e12d-… | associations resolved on the elementary layer |
| 332,314 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/58ca4d96-8abb-… | associations resolved on the elementary layer |
| 334,524 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6044552b-89b6-… | associations resolved on the elementary layer |
| 344,674 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/824fca6c-0e81-… | associations resolved on the elementary layer |
| 348,902 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/90a7c13a-aadb-… | associations resolved on the elementary layer |