5-amino-3-methyl-2,4-thiophenedicarbonitrile
Everything that changed this flow. Back to the flow
e7100a1f-c5cf-488c-b1de-837ef1080d79
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 1 | consensus_match | group_key=5-amino-3-methyl-2,4-thiophenedicarbonitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=52603-48-2; added Common Chemistry CAS names as altLabel: 2,4-Thiophenedicarbonitrile, 5-amino-3-methyl-, 2-Amino-3,5-dicyano-4-methylthiophene; object_uuid=fo-c4fa513dfeac9d32 |
| cas_match_labels | 1 | consensus_match | group_key=5-amino-3-methyl-2,4-thiophenedicarbonitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['pubchem']; cas_sources={'52603-48-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c4fa513dfeac9d32: {'52603-48-2': '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=['52603-48-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[117960, 819555]; selected_pubchem_cids=[819555]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 21,617 | bootstrap_labels | prefLabel | — | [{"@value":"5-amino-3-methyl-2,4-thiophenedicarbonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Bootstrapped prefLabel from legacy name field |
| 21,618 | bootstrap_labels | name | 5-amino-3-methyl-2,4-thiophenedicarbonitrile | — | Purged legacy name field to enforce prefLabel usage |
| 21,619 | bootstrap_labels | synonyms | ["organic","2,4-thiophenedicarbonitrile,5-amino-3-methyl-","amtc","experimental12043-62","experimentalkp08242009c"] | [] | Removed legacy synonyms field in favor of structured labels |
| 188,120 | 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 |
| 188,121 | 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 |
| 220,263 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 246,890 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 246,891 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,892 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.168.185G","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['52603-48-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[117960, 819555]; selected_pubchem_cids=[819555]; 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 |
| 254,004 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | rdkit_pre_consensus from 'CC1=C(SC(=C1C#N)N)C#N'; added: molecular_mass, monoisotopic_mass |
| 263,038 | consensus_match | altLabel | [] | [{"@value":"2,4-Thiophenedicarbonitrile, 5-amino-3-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | group_key=5-amino-3-methyl-2,4-thiophenedicarbonitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=52603-48-2; added Common Chemistry CAS names as altLabel: 2,4-Thiophenedicarbonitrile, 5-amino-3-methyl-, 2-Amino-3,5-dicyano-4-methylthiophene; object_uuid=fo-c4fa513dfeac9d32 |
| 263,039 | consensus_match | cas_match_labels | — | {"52603-48-2":"exactMatch"} | group_key=5-amino-3-methyl-2,4-thiophenedicarbonitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['pubchem']; cas_sources={'52603-48-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c4fa513dfeac9d32: {'52603-48-2': 'exactMatch'} |
| 279,201 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '5-amino-3-methyl-2,4-thiophenedicarbonitrile' |
| 286,058 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | rdkit_post_consensus from 'Cc1c(C#N)sc(N)c1C#N'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 375,088 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e7100a1f-c5cf-… | associations resolved on the elementary layer |
| 393,587 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5N3S"],… | typed the way the ontology types it |
| 402,660 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260821T1302361922970000/21617 | prefLabel | ef:agent/bootstrap_labels | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v0 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v1 |
| ef:activity/change/20260821T1302361922970000/21618 | name | ef:agent/bootstrap_labels | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v1 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v2 |
| ef:activity/change/20260821T1302361922970000/21619 | synonyms | ef:agent/bootstrap_labels | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v2 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v3 |
| ef:activity/change/20260821T1302361922970000/188120 | context | ef:agent/default_context_mapping | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v3 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v4 |
| ef:activity/change/20260821T1302361922970000/188121 | context_iri | ef:agent/default_context_mapping | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v4 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v5 |
| ef:activity/change/20260821T1302361922970000/220263 | unit_iri | ef:agent/unit_normalization | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v5 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v6 |
| ef:activity/change/20260821T1302361922970000/246890 | properties | ef:agent/enrich_references | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v6 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v7 |
| ef:activity/change/20260821T1302361922970000/246891 | skos_definition | ef:agent/enrich_references | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v7 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v8 |
| ef:activity/change/20260821T1302361922970000/246892 | references | ef:agent/enrich_references | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v8 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v9 |
| ef:activity/change/20260821T1302361922970000/254004 | properties | ef:agent/rdkit_pre_consensus | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v9 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v10 |
| ef:activity/change/20260821T1302361922970000/263038 | altLabel | ef:agent/consensus_match | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v10 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v11 |
| ef:activity/change/20260821T1302361922970000/263039 | cas_match_labels | ef:agent/consensus_match | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v11 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v12 |
| ef:activity/change/20260821T1302361922970000/279201 | properties | ef:agent/opsin_iupac | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v12 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v13 |
| ef:activity/change/20260821T1302361922970000/286058 | properties | ef:agent/rdkit_post_consensus | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v13 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v14 |
| ef:activity/change/20260821T1302361922970000/375088 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v14 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v15 |
| ef:activity/change/20260821T1302361922970000/393587 | properties | ef:agent/normalise_property_values | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v15 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v16 |
| ef:activity/change/20260821T1302361922970000/402660 | types | ef:agent/link_flows_to_their_substance | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v16 | ef:flow/e7100a1f-c5cf-488c-b1de-837ef1080d79/v17 |