Methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate
Everything that changed this flow. Back to the flow
8d8c8fb4-7f16-4efc-9920-23a80212e43c
By field
14 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'IR 6141' (grade code) |
| 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=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'} |
| 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 soil > Emissions to non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | 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 |
| roles | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,226 | 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 |
| 9,227 | bootstrap_labels | name | methyl (2s)-2-[n-(2,6-dimethylphenyl)-2-phenylacetamido]propanoate | — | Purged legacy name field to enforce prefLabel usage |
| 9,228 | 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 |
| 133,990 | 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 |
| 133,991 | 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 |
| 216,409 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,268 | 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) |
| 236,009 | 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) |
| 236,010 | 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 |
| 236,011 | 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 |
| 250,853 | 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 |
| 255,716 | 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) |
| 268,686 | 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 |
| 268,687 | 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'} |
| 276,037 | 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' |
| 282,605 | 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 |
| 289,184 | 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) |
| 347,984 | 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 |
| 390,379 | normalise_property_values | 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"… | typed the way the ontology types it |
| 397,961 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 397,962 | link_flows_to_their_substance | roles | — | [{"@id":"http://purl.obolibrary.org/obo/CHEBI_24127","rdfs:label":"fungicide","http://www.w3.org/2004/02/skos/core#defi… | the substance's answer, copied onto its flow |
| 397,963 | link_flows_to_their_substance | 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"… | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260820T1812399309960000/9226 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v0 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v1 |
| ef:activity/change/20260820T1812399309960000/9227 | name | ef:agent/bootstrap_labels | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v1 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v2 |
| ef:activity/change/20260820T1812399309960000/9228 | synonyms | ef:agent/bootstrap_labels | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v2 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v3 |
| ef:activity/change/20260820T1812399309960000/133990 | context | ef:agent/default_context_mapping | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v3 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v4 |
| ef:activity/change/20260820T1812399309960000/133991 | context_iri | ef:agent/default_context_mapping | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v4 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v5 |
| ef:activity/change/20260820T1812399309960000/216409 | unit_iri | ef:agent/unit_normalization | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v5 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v6 |
| ef:activity/change/20260820T1812399309960000/223268 | prefLabel | ef:agent/normalize_name_case | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v6 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v7 |
| ef:activity/change/20260820T1812399309960000/236009 | properties | ef:agent/enrich_references | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v7 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v8 |
| ef:activity/change/20260820T1812399309960000/236010 | skos_definition | ef:agent/enrich_references | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v8 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v9 |
| ef:activity/change/20260820T1812399309960000/236011 | references | ef:agent/enrich_references | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v9 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v10 |
| ef:activity/change/20260820T1812399309960000/250853 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v10 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v11 |
| ef:activity/change/20260820T1812399309960000/255716 | altLabel | ef:agent/chebi_altlabels | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v11 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v12 |
| ef:activity/change/20260820T1812399309960000/268686 | altLabel | ef:agent/consensus_match | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v12 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v13 |
| ef:activity/change/20260820T1812399309960000/268687 | cas_match_labels | ef:agent/consensus_match | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v13 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v14 |
| ef:activity/change/20260820T1812399309960000/276037 | properties | ef:agent/opsin_iupac | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v14 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v15 |
| ef:activity/change/20260820T1812399309960000/282605 | properties | ef:agent/rdkit_post_consensus | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v15 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v16 |
| ef:activity/change/20260820T1812399309960000/289184 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v16 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v17 |
| ef:activity/change/20260820T1812399309960000/347984 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v17 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v18 |
| ef:activity/change/20260820T1812399309960000/390379 | properties | ef:agent/normalise_property_values | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v18 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v19 |
| ef:activity/change/20260820T1812399309960000/397961 | types | ef:agent/link_flows_to_their_substance | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v19 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v20 |
| ef:activity/change/20260820T1812399309960000/397962 | roles | ef:agent/link_flows_to_their_substance | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v20 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v21 |
| ef:activity/change/20260820T1812399309960000/397963 | properties | ef:agent/link_flows_to_their_substance | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v21 | ef:flow/8d8c8fb4-7f16-4efc-9920-23a80212e43c/v22 |