3-aminomethyl-3,5,5-trimethylcyclohexylamine
Everything that changed this flow. Back to the flow
c08e9d4f-fb69-4919-b581-1481474f9122
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 14 catalogue altLabel value(s): 'Chemcure 331' (trade name), 'D 230' (grade code), 'ED 46' (grade code), 'EPH 943' (grade code), 'ER 2943' (grade code), 'Epicure 3300' (trade name), 'Epikure 3300' (trade name), 'Epikure 943' (trade name), 'HY 3484' (grade code), 'HY 5161' (grade code), 'Hardener 200B' (trade name), 'KH 816' (grade code), 'LH 281' (grade code), 'RIM 137' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=3-aminomethyl-3,5,5-trimethylcyclohexylamine||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2855-13-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97146c4abea560b4: {'2855-13-2': '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 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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['2855-13-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[17857, 17959620, 71306741, 71749580]; selected_pubchem_cids=[17857]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 1,236 | bootstrap_labels | prefLabel | — | [{"@value":"3-aminomethyl-3,5,5-trimethylcyclohexylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Bootstrapped prefLabel from legacy name field |
| 1,237 | bootstrap_labels | name | 3-aminomethyl-3,5,5-trimethylcyclohexylamine | — | Purged legacy name field to enforce prefLabel usage |
| 1,238 | bootstrap_labels | synonyms | ["3-(Aminomethyl)-3,5,5-trimethylcyclohexanamine","3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine","5-Amino-1,3,3-tr… | [] | Removed legacy synonyms field in favor of structured labels |
| 163,884 | 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 |
| 163,885 | 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 |
| 213,747 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 228,362 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,363 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,364 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J68.532A","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['2855-13-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[17857, 17959620, 71306741, 71749580]; selected_pubchem_cids=[17857]; 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 |
| 248,657 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | rdkit_pre_consensus from 'CC1(CC(CC(C1)(C)CN)N)C'; added: molecular_mass, monoisotopic_mass |
| 261,898 | consensus_match | altLabel | [] | [{"@value":"1,3,3-Trimethyl-1-aminomethyl-5-aminocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consens… | group_key=3-aminomethyl-3,5,5-trimethylcyclohexylamine||dimension=Environmental > media=Water > water_body=Long-term; cas=2855-13-2; added Common Chemistry CAS names as altLabel: 1,3,3-Trimethyl-1-aminomethyl-5-aminocyclohexane, 1-Amino-3,3,5-trimethyl-5-aminomethylcyclohexane, 1-Amino-3-(aminomethyl)-3,5,5-trimethylcyclohexane, 1-Aminomethyl-5-amino-1,3,3-trimethyl cyclohexane, 3,3,5-Trimethyl-5-aminomethylcyclohexylamine, 3-(Aminomethyl)-3,5,5-trimethylcyclohexanamine, 3-Amino-1,5,5-trimethyl-1-cyclohexanemathanamine, 3-Aminomethyl-3,5,5-trimethyl-1-aminocyclohexane, 3-Aminomethyl-3,5,5-trimethyl-1-cyclohexylamine, 5-Amino-1,3,3-trimethylcyclohexanemethanamine, 5-Amino-1,3,3-trimethylcyclohexanemethylamine, Aradur 42, Aradur 42BD, Araldite HY 5083, Araldite HY 5161, Baxxodur EC 201, CeTePox 1314NFN, Chemammina CA 17, Chemcure 331, Cyclohexanemethanamine, 5-amino-1,3,3-trimethyl-, Cyclohexanemethylamine, 5-amino-1,3,3-trimethyl-, D 230, Docure KH 816, ED 46, EPH 943, ER 2943, Epicure 3300, Epikure 3300, Epikure 943, Epilox IPD, HY 3484, HY 5161, Hardener 200B, IPD, IPDA, Isophorondiamine, Isophorone diamine, KH 816, LH 281, Luxam IPD, Nitoprime 25 Hardener, Polypox IPD, RIM 137, Rutadur SG, Rutapox H 550L, Surf Clear SCD, Vestamid IPD, Vestamin IPD, Vestamine IPDA, Vestanat IPD, Wanamine IPDA; object_uuid=fo-97146c4abea560b4 |
| 261,899 | consensus_match | cas_match_labels | — | {"2855-13-2":"exactMatch"} | group_key=3-aminomethyl-3,5,5-trimethylcyclohexylamine||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2855-13-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97146c4abea560b4: {'2855-13-2': 'exactMatch'} |
| 273,778 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-aminomethyl-3,5,5-trimethylcyclohexylamine' |
| 280,157 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | rdkit_post_consensus from 'CC1(C)CC(N)CC(C)(CN)C1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,500 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3,3-Trimethyl-1-aminomethyl-5-aminocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consens… | [{"@value":"1,3,3-Trimethyl-1-aminomethyl-5-aminocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consens… | Removed 14 catalogue altLabel value(s): 'Chemcure 331' (trade name), 'D 230' (grade code), 'ED 46' (grade code), 'EPH 943' (grade code), 'ER 2943' (grade code), 'Epicure 3300' (trade name), 'Epikure 3300' (trade name), 'Epikure 943' (trade name), 'HY 3484' (grade code), 'HY 5161' (grade code), 'Hardener 200B' (trade name), 'KH 816' (grade code), 'LH 281' (grade code), 'RIM 137' (grade code) |
| 362,961 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c08e9d4f-fb69-… | associations resolved on the elementary layer |
| 388,054 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22N2"]… | typed the way the ontology types it |
| 394,647 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260820T1812399309960000/1236 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v0 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v1 |
| ef:activity/change/20260820T1812399309960000/1237 | name | ef:agent/bootstrap_labels | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v1 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v2 |
| ef:activity/change/20260820T1812399309960000/1238 | synonyms | ef:agent/bootstrap_labels | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v2 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v3 |
| ef:activity/change/20260820T1812399309960000/163884 | context | ef:agent/default_context_mapping | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v3 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v4 |
| ef:activity/change/20260820T1812399309960000/163885 | context_iri | ef:agent/default_context_mapping | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v4 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v5 |
| ef:activity/change/20260820T1812399309960000/213747 | unit_iri | ef:agent/unit_normalization | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v5 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v6 |
| ef:activity/change/20260820T1812399309960000/228362 | properties | ef:agent/enrich_references | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v6 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v7 |
| ef:activity/change/20260820T1812399309960000/228363 | skos_definition | ef:agent/enrich_references | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v7 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v8 |
| ef:activity/change/20260820T1812399309960000/228364 | references | ef:agent/enrich_references | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v8 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v9 |
| ef:activity/change/20260820T1812399309960000/248657 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v9 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v10 |
| ef:activity/change/20260820T1812399309960000/261898 | altLabel | ef:agent/consensus_match | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v10 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v11 |
| ef:activity/change/20260820T1812399309960000/261899 | cas_match_labels | ef:agent/consensus_match | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v11 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v12 |
| ef:activity/change/20260820T1812399309960000/273778 | properties | ef:agent/opsin_iupac | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v12 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v13 |
| ef:activity/change/20260820T1812399309960000/280157 | properties | ef:agent/rdkit_post_consensus | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v13 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v14 |
| ef:activity/change/20260820T1812399309960000/287500 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v14 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v15 |
| ef:activity/change/20260820T1812399309960000/362961 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v15 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v16 |
| ef:activity/change/20260820T1812399309960000/388054 | properties | ef:agent/normalise_property_values | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v16 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v17 |
| ef:activity/change/20260820T1812399309960000/394647 | types | ef:agent/link_flows_to_their_substance | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v17 | ef:flow/c08e9d4f-fb69-4919-b581-1481474f9122/v18 |