5-amino-[2s-di(methylphenyl)amino]-1,6-diphenyl-4z-hexen-3-one
Everything that changed this flow. Back to the flow
c4350e4d-3b4e-412b-b2ff-2fe494983694
By field
13 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 | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=5-amino-[2s-di(methylphenyl)amino]-1,6-diphenyl-4z-hexen-3-one||dimension=Environmental > media=Water > water_body=Unknown; group_sources=[]; cas_sources={'156732-13-7': []}; assigned CAS labels from group consensus; object_uuid=fo-f13996db5c0f5c87: {'156732-13-7': '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 air, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 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=['156732-13-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[10049917, 18758909, 29940807, 44182012, 53394942, 57370196, 77520660]; selected_pubchem_cids=[57370196]; 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 |
|---|---|---|---|---|---|
| 2,127 | bootstrap_labels | prefLabel | — | [{"@value":"5-amino-[2s-di(methylphenyl)amino]-1,6-diphenyl-4z-hexen-3-one","@language":"en","source":{"prov:wasGenerat… | Bootstrapped prefLabel from legacy name field |
| 2,128 | bootstrap_labels | name | 5-amino-[2s-di(methylphenyl)amino]-1,6-diphenyl-4z-hexen-3-one | — | Purged legacy name field to enforce prefLabel usage |
| 2,129 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 166,000 | 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 |
| 166,001 | 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 |
| 214,048 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 229,225 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,226 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,227 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.102.166","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['156732-13-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[10049917, 18758909, 29940807, 44182012, 53394942, 57370196, 77520660]; selected_pubchem_cids=[57370196]; 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 |
| 248,906 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | rdkit_pre_consensus from 'C1=CC=C(C=C1)CC(C(=O)C=C(CC2=CC=CC=C2)N)N(CC3=CC=CC=C3)CC4=CC=CC=C4'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 263,042 | consensus_match | altLabel | [] | [{"@value":"(2<em>S</em>)-5-Amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-4-hexen-3-one","@language":"en","source":{"pr… | group_key=5-amino-[2s-di(methylphenyl)amino]-1,6-diphenyl-4z-hexen-3-one||dimension=Environmental > media=Water > water_body=Unknown; cas=156732-13-7; added Common Chemistry CAS names as altLabel: (2<em>S</em>)-5-Amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-4-hexen-3-one, (2S)-5-Amino-2-(dibenzylamino)-1,6-diphenylhex-4-en-3-one, (<em>S</em>)-2-Amino-5-(<em>N</em>,<em>N</em>-dibenzylamino)-4-oxo-1,6-diphenylhex-2-ene, 4-Hexen-3-one, 5-amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-, (2<em>S</em>)-, 4-Hexen-3-one, 5-amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-, (<em>S</em>)-; object_uuid=fo-f13996db5c0f5c87 |
| 263,043 | consensus_match | cas_match_labels | — | {"156732-13-7":"exactMatch"} | group_key=5-amino-[2s-di(methylphenyl)amino]-1,6-diphenyl-4z-hexen-3-one||dimension=Environmental > media=Water > water_body=Unknown; group_sources=[]; cas_sources={'156732-13-7': []}; assigned CAS labels from group consensus; object_uuid=fo-f13996db5c0f5c87: {'156732-13-7': 'exactMatch'} |
| 274,025 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(2S)-5-Amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-4-hexen-3-one' |
| 280,432 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | rdkit_post_consensus from 'NC(=CC(=O)[C@H](Cc1ccccc1)N(Cc1ccccc1)Cc1ccccc1)Cc1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,076 | dedupe_altlabels | altLabel | [{"@value":"(2<em>S</em>)-5-Amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-4-hexen-3-one","@language":"en","source":{"pr… | [{"@value":"(2S)-5-Amino-2-[bis(phenylmethyl)amino]-1,6-diphenyl-4-hexen-3-one","@language":"en","source":{"prov:wasGen… | Deduplicated altLabel values and removed entries matching prefLabel |
| 364,026 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c4350e4d-3b4e-… | associations resolved on the elementary layer |
| 388,315 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | typed the way the ontology types it |
| 394,994 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 394,995 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C32H32N2O"… | 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/20260821T1554374006150000/2127 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v0 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v1 |
| ef:activity/change/20260821T1554374006150000/2128 | name | ef:agent/bootstrap_labels | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v1 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v2 |
| ef:activity/change/20260821T1554374006150000/2129 | synonyms | ef:agent/bootstrap_labels | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v2 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v3 |
| ef:activity/change/20260821T1554374006150000/166000 | context | ef:agent/default_context_mapping | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v3 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v4 |
| ef:activity/change/20260821T1554374006150000/166001 | context_iri | ef:agent/default_context_mapping | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v4 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v5 |
| ef:activity/change/20260821T1554374006150000/214048 | unit_iri | ef:agent/unit_normalization | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v5 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v6 |
| ef:activity/change/20260821T1554374006150000/229225 | properties | ef:agent/enrich_references | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v6 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v7 |
| ef:activity/change/20260821T1554374006150000/229226 | skos_definition | ef:agent/enrich_references | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v7 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v8 |
| ef:activity/change/20260821T1554374006150000/229227 | references | ef:agent/enrich_references | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v8 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v9 |
| ef:activity/change/20260821T1554374006150000/248906 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v9 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v10 |
| ef:activity/change/20260821T1554374006150000/263042 | altLabel | ef:agent/consensus_match | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v10 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v11 |
| ef:activity/change/20260821T1554374006150000/263043 | cas_match_labels | ef:agent/consensus_match | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v11 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v12 |
| ef:activity/change/20260821T1554374006150000/274025 | properties | ef:agent/opsin_iupac | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v12 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v13 |
| ef:activity/change/20260821T1554374006150000/280432 | properties | ef:agent/rdkit_post_consensus | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v13 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v14 |
| ef:activity/change/20260821T1554374006150000/292076 | altLabel | ef:agent/dedupe_altlabels | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v14 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v15 |
| ef:activity/change/20260821T1554374006150000/364026 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v15 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v16 |
| ef:activity/change/20260821T1554374006150000/388315 | properties | ef:agent/normalise_property_values | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v16 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v17 |
| ef:activity/change/20260821T1554374006150000/394994 | types | ef:agent/link_flows_to_their_substance | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v17 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v18 |
| ef:activity/change/20260821T1554374006150000/394995 | properties | ef:agent/link_flows_to_their_substance | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v18 | ef:flow/c4350e4d-3b4e-412b-b2ff-2fe494983694/v19 |