Cetrimonium Chloride
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-01b515cf8efb6d59
Changes
57| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,737 | bootstrap_labels | prefLabel | — | [{"@value":"cetrimonium chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Bootstrapped prefLabel from legacy name field |
| 5,738 | bootstrap_labels | name | cetrimonium chloride | — | Purged legacy name field to enforce prefLabel usage |
| 5,739 | bootstrap_labels | synonyms | ["cetrimoniumchloride","1-hexadecanaminium, n,n,n-trimethyl-, chloride","microcarequatctc","1-hexadecanaminium,n,n,n-tr… | [] | Removed legacy synonyms field in favor of structured labels |
| 14,638 | bootstrap_labels | synonyms | ["1-Hexadecanaminium, N,N,N-trimethyl-, chloride","1-Hexadecanaminium, N,N,N-trimethyl-, chloride (1:1)","AC1L1QDX","AC… | [] | Removed legacy synonyms field in favor of structured labels |
| 30,959 | 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 |
| 30,960 | 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 |
| 49,653 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 49,654 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 54,433 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 54,434 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 66,651 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 66,652 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 86,115 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 86,116 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 106,755 | 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 |
| 106,756 | 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 |
| 136,547 | 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 |
| 136,548 | 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 |
| 174,429 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 174,430 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 174,483 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 174,484 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 177,195 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 177,196 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 181,757 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 181,758 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 193,051 | 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 |
| 193,052 | 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 |
| 197,549 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 197,550 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 215,258 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,424 | normalize_name_case | prefLabel | [{"@value":"cetrimonium chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | [{"@value":"Cetrimonium Chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,706 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,707 | enrich_references | skos_definition | — | [{"@value":"The organic chloride salt of cetyltrimethylammonium.","@language":"en","provenance":{"prov:wasGeneratedBy":… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,708 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.003.571","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['112-02-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_53581']; candidate_pubchem_cids=[8154, 21553980]; selected_pubchem_cids=[8154]; 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 |
| 249,913 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]'; added: monoisotopic_mass |
| 255,108 | chebi_altlabels | altLabel | [] | [{"@value":"Arquad 16-50","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"br… | Added 10 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 264,967 | consensus_match | altLabel | [{"@value":"Arquad 16-50","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"br… | [{"@value":"Arquad 16-50","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"br… | group_key=cetrimoniumchloride||dimension=Environmental > media=Air > indoor=Unknown; cas=112-02-7; added Common Chemistry CAS names as altLabel: 1-Hexadecanaminium, <em>N</em>,<em>N</em>,<em>N</em>-trimethyl-, chloride, 1-Hexadecanaminium, <em>N</em>,<em>N</em>,<em>N</em>-trimethyl-, chloride (1:1), 1631CL, <em>N</em>-Palmityl-<em>N</em>,<em>N</em>,<em>N</em>-trimethylammonium chloride, <em>n</em>-Hexadecyltrimethylammonium chloride, Adogen 444, Adogen 444-29, Aliquat 1529, Aliquat 6, Alkapav 16S50, Ammonium, hexadecyltrimethyl-, chloride, Ammonyx CETAC 25, Ammonyx Cetac, Ammonyx Cetac 30, Arquad 16, Arquad 16-25, Arquad 16-25LO, Arquad 16-25W, Arquad 16-26, Arquad 16-29, Arquad 16-29W, BP 40, Barquat CT 29, Belsil ADM 4000 E, C 16TAC, CA 2350, CETAC, CM 29, CTAC 1, CTAC 30KC, CTAC CT-429, CTACL, CTMA, Carsoquat CT 425, Carsoquat CT 429, Catinal CTC 70ET, Catiogen TMP, Catiogen TMR, Cation PB 300, Cation PB 40, Cationic 1631, Cationic Surfactant 1631, Cetac 30, Cetyltrimethylammomium chloride, Cetyltrimethylammonium chloride, D 1631, Dehyquart A, Dehyquart A-CA, Dehyquart A-CE, Dodigen 1383, FSM 28, Fentacare 1631-70, Fentacare 1831-70, Genamin CTAC, Genamin CTAC 50, Genamin CTAC 50ET, Geranium CTAC, HDTMA-Cl, HTAC, Hexadecyltrimethylammonium chloride, Incroquat CTC 30, Intexan CTC 29, Intexsan CTC 29, Intexsan CTC 50, Lebon TM 16, Lebon TM 60, Lipoquad 16-29, Morpan CHA, Nikkol CA 2330, Nikkol CA-2350E, Nissan Cation PB 40, Nissan Cation PB 40R, PB 40, Pionin B 611, Protaquat CT 29, Quartamin 60W, Quartamin 60W30, Quatramine C 16/29, Saboquat, Surfroyal CTAC, Swanol CA 2350, Variquat E 228, Varisoft 300; object_uuid=fo-01b515cf8efb6d59 |
| 264,968 | consensus_match | cas_match_labels | — | {"112-02-7":"exactMatch"} | group_key=cetrimoniumchloride||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'112-02-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-01b515cf8efb6d59: {'112-02-7': 'exactMatch'} |
| 275,050 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Cetyl trimethyl ammonium chloride' |
| 281,541 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H42ClN"… | rdkit_post_consensus from 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,438 | strip_catalogue_altlabels | altLabel | [{"@value":"Arquad 16-50","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"br… | [{"@value":"Arquad 16-50","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"br… | Removed 13 catalogue altLabel value(s): 'Adogen 444' (trade name), 'Aliquat 1529' (trade name), 'BP 40' (grade code), 'CA 2350' (grade code), 'CM 29' (grade code), 'CTAC 1' (grade code), 'Cationic 1631' (trade name), 'Cationic Surfactant 1631' (trade name), 'D 1631' (grade code), 'Dodigen 1383' (trade name), 'FSM 28' (grade code), 'PB 40' (grade code), 'Varisoft 300' (trade name) |
| 296,559 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0714db54-01e1-… | associations resolved on the elementary layer |
| 305,894 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/14c48662-484b-… | associations resolved on the elementary layer |
| 308,284 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1b2c7771-e657-… | associations resolved on the elementary layer |
| 314,383 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2cc386a1-9db7-… | associations resolved on the elementary layer |
| 324,112 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4ba75c1f-ac5b-… | associations resolved on the elementary layer |
| 334,413 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5ff45c2a-2cfd-… | associations resolved on the elementary layer |
| 349,306 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/921c43a1-46f9-… | associations resolved on the elementary layer |
| 368,270 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d26e9718-9c69-… | associations resolved on the elementary layer |