Methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-cc13238b7b1447f8
Changes
58| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,228 | bootstrap_labels | prefLabel | — | [{"@value":"methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate","@language":"en","source":{"prov:wasGen… | Bootstrapped prefLabel from legacy name field |
| 9,229 | bootstrap_labels | name | methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate | — | Purged legacy name field to enforce prefLabel usage |
| 9,230 | bootstrap_labels | synonyms | ["organic","d-alanine,n-(2,6-dimethylphenyl)-n-(2-phenylacetyl)-,methylesterothernamesmethyln-(phenylacetyl)-n-(2,6-xyl… | [] | Removed legacy synonyms field in favor of structured labels |
| 41,772 | 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 |
| 41,773 | 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 |
| 48,488 | 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 |
| 48,489 | 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 |
| 53,354 | 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 |
| 53,355 | 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 |
| 71,794 | 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 |
| 71,795 | 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 |
| 83,618 | 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) |
| 83,619 | 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) |
| 128,460 | 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 |
| 128,461 | 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 |
| 133,996 | 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 |
| 133,997 | 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 |
| 136,774 | 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 |
| 136,775 | 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 |
| 164,068 | 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 |
| 164,069 | 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 |
| 165,460 | 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 |
| 165,461 | 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 |
| 166,040 | 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) |
| 166,041 | 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) |
| 170,272 | 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 |
| 170,273 | 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 |
| 201,340 | 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 |
| 201,341 | 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 |
| 216,415 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,274 | normalize_name_case | prefLabel | [{"@value":"methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate","@language":"en","source":{"prov:wasGen… | [{"@value":"Methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate","@language":"en","source":{"prov:wasGen… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,017 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 236,018 | enrich_references | skos_definition | — | [{"@value":"A methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)alaninate that is the more active R-enantiomer of benalaxyl… | Merged ChEBI/PubChem definitions into skos:definition |
| 236,019 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J259.943K","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['98243-83-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82779']; candidate_pubchem_cids=[51369, 176648]; selected_pubchem_cids=[176648]; 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 |
| 250,861 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | rdkit_pre_consensus from 'CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2'; added: inchi2d_string, monoisotopic_mass |
| 255,725 | chebi_altlabels | altLabel | [] | [{"@value":"(-)-R-Benalaxyl","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 268,710 | consensus_match | altLabel | [{"@value":"(-)-R-Benalaxyl","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":… | [{"@value":"(-)-R-Benalaxyl","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":… | group_key=methyl(2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=98243-83-5; added Common Chemistry CAS names as altLabel: (-)-Benalaxyl, (<em>R</em>)-Benalaxyl, (R)-Methyl 2-(<em>N</em>-(2,6-dimethylphenyl)-2-phenylacetamido)propanoate, <span class="text-smallcaps">D</span>-Alanine, <em>N</em>-(2,6-dimethylphenyl)-<em>N</em>-(2-phenylacetyl)-, methyl ester, <span class="text-smallcaps">D</span>-Alanine, <em>N</em>-(2,6-dimethylphenyl)-<em>N</em>-(phenylacetyl)-, methyl ester, Benalaxyl-M; object_uuid=fo-cc13238b7b1447f8 |
| 268,711 | consensus_match | cas_match_labels | — | {"98243-83-5":"exactMatch"} | group_key=methyl(2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi']; cas_sources={'98243-83-5': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-cc13238b7b1447f8: {'98243-83-5': 'exactMatch'} |
| 276,061 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate' |
| 282,631 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H23NO3"… | rdkit_post_consensus from 'COC(=O)[C@@H](C)N(C(=O)Cc1ccccc1)c1c(C)cccc1C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,212 | strip_catalogue_altlabels | altLabel | [{"@value":"(-)-R-Benalaxyl","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":… | [{"@value":"(-)-R-Benalaxyl","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":… | Removed 1 catalogue altLabel value(s): 'IR 6141' (grade code) |
| 301,931 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08cc407b-8962-… | associations resolved on the elementary layer |
| 305,291 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/12c85781-b705-… | associations resolved on the elementary layer |
| 307,724 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/197d438e-1595-… | associations resolved on the elementary layer |
| 316,934 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/34657d1b-066e-… | associations resolved on the elementary layer |
| 322,843 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4726fa51-667b-… | associations resolved on the elementary layer |
| 345,252 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/843f9322-94d4-… | associations resolved on the elementary layer |
| 348,014 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8d8c8fb4-7f16-… | associations resolved on the elementary layer |
| 349,403 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/92723bc2-2807-… | associations resolved on the elementary layer |
| 363,080 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c0df20a8-f293-… | associations resolved on the elementary layer |