Hexamethylenetetramine
Everything that changed this flow. Back to the flow
38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 10 catalogue altLabel value(s): 'EL 10' (grade code), 'EL 10 (corrosion inhibitor)' (grade code), 'H 80' (grade code), 'HEXA 80' (grade code), 'KH 8410' (grade code), 'NSC 26346' (registry code), 'NSC 403347' (registry code), 'S 4' (grade code), 'S 4 (heterocycle)' (grade code), 'Thixon 715B' (trade name) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=100-97-0; cc_chebi_agreed_name='Hexamethylenetetramine'; object_uuid=fo-4787467dbfb1a686 |
| cas_match_labels | 1 | consensus_match | group_key=methenamine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'100-97-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4787467dbfb1a686: {'100-97-0': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['100-97-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_6824']; candidate_pubchem_cids=[4101, 18373724, 53414496]; selected_pubchem_cids=[4101]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 20,764 | bootstrap_labels | prefLabel | — | [{"@value":"methenamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"br… | Bootstrapped prefLabel from legacy name field |
| 20,765 | bootstrap_labels | name | methenamine | — | Purged legacy name field to enforce prefLabel usage |
| 21,332 | bootstrap_labels | synonyms | ["hexamethylenetetramine","methenamine","hexamethylenetetramine (aliphatic)","1,3,5,7-tetraazatricyclo[3.3.1.13,7]decan… | [] | Removed legacy synonyms field in favor of structured labels |
| 74,343 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 74,344 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 220,048 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,799 | normalize_name_case | prefLabel | [{"@value":"methenamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"br… | [{"@value":"Methenamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"br… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 246,313 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 246,314 | enrich_references | skos_definition | — | [{"@value":"A polycyclic cage that is adamantane in which the carbon atoms at positions 1, 3, 5 and 7 are replaced by n… | Merged ChEBI/PubChem definitions into skos:definition |
| 246,315 | enrich_references | references | [] | [{"@id":"drugcentral:3344","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['100-97-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_6824']; candidate_pubchem_cids=[4101, 18373724, 53414496]; selected_pubchem_cids=[4101]; 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 |
| 253,843 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | rdkit_pre_consensus from 'C1N2CN3CN1CN(C2)C3'; added: monoisotopic_mass |
| 257,039 | chebi_altlabels | altLabel | [] | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | Added 15 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 268,660 | consensus_match | prefLabel | [{"@value":"Methenamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"br… | [{"@value":"Hexamethylenetetramine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribu… | cas=100-97-0; cc_chebi_agreed_name='Hexamethylenetetramine'; object_uuid=fo-4787467dbfb1a686 |
| 268,661 | consensus_match | altLabel | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | cas=100-97-0; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-4787467dbfb1a686 |
| 268,662 | consensus_match | altLabel | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | group_key=methenamine||dimension=Environmental > media=Water > water_body=Unknown; cas=100-97-0; added Common Chemistry CAS names as altLabel: 1,3,5,7-Tetraazatricyclo[3.3.1.1<sup>3,7</sup>]decane, 1,3,5,7-Tetraazatricyclo[3.3.1.1<sup>3,7</sup>]decane (Urotropine), Accelerator H, Aceto HMT, Aminoform, Ammoform, Antihydral, Cohedur H 30, Cystogen, Duirexol, EL 10, EL 10 (corrosion inhibitor), Ekagom H, Formamine, Formin, Formin (heterocycle), H 80, HA, HEXA 80, Heksa K, Herax UTS, Heterin, Hexa, Hexa (vulcanization accelerator), Hexa B, Hexa-Flo-Pulver, Hexaform, Hexamine (heterocycle), Hexamine Superfine, Hexasan, KH 8410, Methenamide, Methenamin, NSC 26346, NSC 403347, Nocceler H, Nocceler H-PO, Nocrac H, Preparation AF, Rhenogran HEXA 80, Rhenogran HEXA 80SBR, S 4, S 4 (heterocycle), Sanceler H, Sanceler HMT, Sanceler HT, Sanceler HT-PO, Thixon 715B, Uramin, Uratrine, Urodeine, Urotropine, Vulkacit H, Vulkacit H 30, Xametrin; object_uuid=fo-4787467dbfb1a686 |
| 268,663 | consensus_match | cas_match_labels | — | {"100-97-0":"exactMatch"} | group_key=methenamine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'100-97-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4787467dbfb1a686: {'100-97-0': 'exactMatch'} |
| 279,047 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3,5,7-tetraazaadamantane' |
| 285,875 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | rdkit_post_consensus from 'C1N2CN3CN1CN(C2)C3'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,392 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | [{"@value":"1,3,5,7-tetraazaadamantane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAtt… | Removed 10 catalogue altLabel value(s): 'EL 10' (grade code), 'EL 10 (corrosion inhibitor)' (grade code), 'H 80' (grade code), 'HEXA 80' (grade code), 'KH 8410' (grade code), 'NSC 26346' (registry code), 'NSC 403347' (registry code), 'S 4' (grade code), 'S 4 (heterocycle)' (grade code), 'Thixon 715B' (trade name) |
| 318,227 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/38c6b2f9-cae9-… | associations resolved on the elementary layer |
| 393,453 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H12N4"],… | typed the way the ontology types it |
| 402,399 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20261019T0712047113160000/20764 | prefLabel | ef:agent/bootstrap_labels | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v0 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v1 |
| ef:activity/change/20261019T0712047113160000/20765 | name | ef:agent/bootstrap_labels | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v1 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v2 |
| ef:activity/change/20261019T0712047113160000/21332 | synonyms | ef:agent/bootstrap_labels | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v2 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v3 |
| ef:activity/change/20261019T0712047113160000/74343 | context | ef:agent/default_context_mapping | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v3 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v4 |
| ef:activity/change/20261019T0712047113160000/74344 | context_iri | ef:agent/default_context_mapping | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v4 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v5 |
| ef:activity/change/20261019T0712047113160000/220048 | unit_iri | ef:agent/unit_normalization | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v5 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v6 |
| ef:activity/change/20261019T0712047113160000/225799 | prefLabel | ef:agent/normalize_name_case | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v6 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v7 |
| ef:activity/change/20261019T0712047113160000/246313 | properties | ef:agent/enrich_references | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v7 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v8 |
| ef:activity/change/20261019T0712047113160000/246314 | skos_definition | ef:agent/enrich_references | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v8 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v9 |
| ef:activity/change/20261019T0712047113160000/246315 | references | ef:agent/enrich_references | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v9 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v10 |
| ef:activity/change/20261019T0712047113160000/253843 | properties | ef:agent/rdkit_pre_consensus | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v10 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v11 |
| ef:activity/change/20261019T0712047113160000/257039 | altLabel | ef:agent/chebi_altlabels | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v11 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v12 |
| ef:activity/change/20261019T0712047113160000/268660 | prefLabel | ef:agent/consensus_match | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v12 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v13 |
| ef:activity/change/20261019T0712047113160000/268661 | altLabel | ef:agent/consensus_match | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v13 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v14 |
| ef:activity/change/20261019T0712047113160000/268662 | altLabel | ef:agent/consensus_match | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v14 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v15 |
| ef:activity/change/20261019T0712047113160000/268663 | cas_match_labels | ef:agent/consensus_match | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v15 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v16 |
| ef:activity/change/20261019T0712047113160000/279047 | properties | ef:agent/opsin_iupac | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v16 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v17 |
| ef:activity/change/20261019T0712047113160000/285875 | properties | ef:agent/rdkit_post_consensus | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v17 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v18 |
| ef:activity/change/20261019T0712047113160000/291392 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v18 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v19 |
| ef:activity/change/20261019T0712047113160000/318227 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v19 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v20 |
| ef:activity/change/20261019T0712047113160000/393453 | properties | ef:agent/normalise_property_values | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v20 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v21 |
| ef:activity/change/20261019T0712047113160000/402399 | types | ef:agent/link_flows_to_their_substance | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v21 | ef:flow/38c6b2f9-cae9-4d4a-8bc0-dd80ae2b0d67/v22 |