Cyclohexane-1,3-diyldimethanamine
Everything that changed this flow. Back to the flow
6216cce7-45c8-4012-9a2d-a8202d1e9452
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 | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'B 2413' (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=cyclohexane-1,3-diyldimethanamine||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2579-20-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-11abee31f9ebc1b2: {'2579-20-6': '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=['2579-20-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[17406, 6951510, 53395031]; selected_pubchem_cids=[17406]; 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 |
|---|---|---|---|---|---|
| 12,571 | bootstrap_labels | prefLabel | — | [{"@value":"cyclohexane-1,3-diyldimethanamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Bootstrapped prefLabel from legacy name field |
| 12,572 | bootstrap_labels | name | cyclohexane-1,3-diyldimethanamine | — | Purged legacy name field to enforce prefLabel usage |
| 12,573 | bootstrap_labels | synonyms | ["organic","1,3-cyclohexanedimethanamine"] | [] | Removed legacy synonyms field in favor of structured labels |
| 108,014 | 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 |
| 108,015 | 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 |
| 217,499 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,008 | normalize_name_case | prefLabel | [{"@value":"cyclohexane-1,3-diyldimethanamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | [{"@value":"Cyclohexane-1,3-diyldimethanamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,122 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,123 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,124 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J48.534I","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['2579-20-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[17406, 6951510, 53395031]; selected_pubchem_cids=[17406]; 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 |
| 251,749 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | rdkit_pre_consensus from 'C1CC(CC(C1)CN)CN'; added: molecular_mass, monoisotopic_mass |
| 265,416 | consensus_match | altLabel | [] | [{"@value":"1,3-BAC","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | group_key=cyclohexane-1,3-diyldimethanamine||dimension=Environmental > media=Ground > geography=Unknown; cas=2579-20-6; added Common Chemistry CAS names as altLabel: 1,3-BAC, 1,3-Bis(aminomethyl)cyclohexane, 1,3-Bis(methylamine)cyclohexane, 1,3-Cyclohexanebis(methylamine), 1,3-Cyclohexanedimethanamine, 1,3-Cyclohexanedimethylamine, 1,3-Di(aminomethyl)cyclohexane, <em>m</em>-Bis(aminomethyl)cyclohexane, B 2413, Baxxodur EC 2120, Daitocurar B 2413, Hydrogenated <em>m</em>-XDA, Hydrogenated <em>m</em>-xylylenediamine, [3-(Aminomethyl)cyclohexyl]methanamine, [[3-(Aminomethyl)cyclohexyl]methyl]amine; object_uuid=fo-11abee31f9ebc1b2 |
| 265,417 | consensus_match | cas_match_labels | — | {"2579-20-6":"exactMatch"} | group_key=cyclohexane-1,3-diyldimethanamine||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2579-20-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-11abee31f9ebc1b2: {'2579-20-6': 'exactMatch'} |
| 276,936 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Cyclohexane-1,3-diyldimethanamine' |
| 283,586 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | rdkit_post_consensus from 'NCC1CCCC(CN)C1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,850 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3-BAC","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | [{"@value":"1,3-BAC","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | Removed 1 catalogue altLabel value(s): 'B 2413' (grade code) |
| 335,005 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6216cce7-45c8-… | associations resolved on the elementary layer |
| 391,294 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18N2"],… | typed the way the ontology types it |
| 399,262 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260822T0600486828500000/12571 | prefLabel | ef:agent/bootstrap_labels | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v0 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v1 |
| ef:activity/change/20260822T0600486828500000/12572 | name | ef:agent/bootstrap_labels | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v1 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v2 |
| ef:activity/change/20260822T0600486828500000/12573 | synonyms | ef:agent/bootstrap_labels | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v2 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v3 |
| ef:activity/change/20260822T0600486828500000/108014 | context | ef:agent/default_context_mapping | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v3 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v4 |
| ef:activity/change/20260822T0600486828500000/108015 | context_iri | ef:agent/default_context_mapping | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v4 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v5 |
| ef:activity/change/20260822T0600486828500000/217499 | unit_iri | ef:agent/unit_normalization | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v5 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v6 |
| ef:activity/change/20260822T0600486828500000/224008 | prefLabel | ef:agent/normalize_name_case | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v6 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v7 |
| ef:activity/change/20260822T0600486828500000/239122 | properties | ef:agent/enrich_references | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v7 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v8 |
| ef:activity/change/20260822T0600486828500000/239123 | skos_definition | ef:agent/enrich_references | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v8 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v9 |
| ef:activity/change/20260822T0600486828500000/239124 | references | ef:agent/enrich_references | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v9 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v10 |
| ef:activity/change/20260822T0600486828500000/251749 | properties | ef:agent/rdkit_pre_consensus | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v10 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v11 |
| ef:activity/change/20260822T0600486828500000/265416 | altLabel | ef:agent/consensus_match | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v11 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v12 |
| ef:activity/change/20260822T0600486828500000/265417 | cas_match_labels | ef:agent/consensus_match | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v12 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v13 |
| ef:activity/change/20260822T0600486828500000/276936 | properties | ef:agent/opsin_iupac | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v13 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v14 |
| ef:activity/change/20260822T0600486828500000/283586 | properties | ef:agent/rdkit_post_consensus | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v14 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v15 |
| ef:activity/change/20260822T0600486828500000/289850 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v15 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v16 |
| ef:activity/change/20260822T0600486828500000/335005 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v16 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v17 |
| ef:activity/change/20260822T0600486828500000/391294 | properties | ef:agent/normalise_property_values | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v17 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v18 |
| ef:activity/change/20260822T0600486828500000/399262 | types | ef:agent/link_flows_to_their_substance | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v18 | ef:flow/6216cce7-45c8-4012-9a2d-a8202d1e9452/v19 |