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Methapyrilene Hydrochloride

UUID 08a91e70-3ddc-11dd-a22e-0050c2490048
Flow Object IDfo-55a72387c9744fac
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 135-23-9
EC Numbers 205-184-8
prefLabel
Language Value Provenance
en Methapyrilene Hydrochloride
altLabel ⓘ
Language Value Provenance
en 2-((2-(Dimethylamino)ethyl)-2-thenylamino)pyridine monohydrochloride
en Methoxylene
en N,N-dimethyl-N'-pyridin-2-yl-N'-[(thiophen-2-yl)methyl]ethane-1,2-diamine hydrochloride
en Thenylene hydrochloride
en Thenylpyramine hydrochloride
en methypyrilene hydrochloride
en 1,2-Ethanediamine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-2-pyridinyl-<em>N</em>′-(2-thienylmethyl)-, monohydrochloride
en 1,2-Ethanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>1</sup>-dimethyl-<em>N</em><sup>2</sup>-2-pyridinyl-<em>N</em><sup>2</sup>-(2-thienylmethyl)-, hydrochloride (1:1)
en 2-[[2-(Dimethylamino)ethyl]-2-thenylamino]pyridine hydrochloride
en <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-thenyl)-<em>N</em>′-(2-pyridyl-ethylene-diamine hydrochloride)
en Barhist
en Blue Line
en Bu-pyra-hist
en Bu-pyra-histrit
en Butyl-pyra-hist
en Capathyn
en Cohistine
en Coryzol
en Histadyl
en Histafed
en Lullamin
en Methacon
en Pyrathyn
en Pyridine, 2-[[2-(dimethylamino)ethyl]-2-thenylamino]-, monohydrochloride
en Somnicaps
en Tem-Histine
en Teralin
en Methapyrilene Hydochloride
Definitions
Language Value Provenance
en A hydrochloride that is the monohydrochloride salt of methapyrilene.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey BONORRGKLJBGRV-UHFFFAOYSA-N
InChI InChI=1S/C14H19N3S.ClH/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;/h3-8,11H,9-10,12H2,1-2H3;1H
IUPAC name N,N-dimethyl-N'-(2-pyridinyl)-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine;hydrochloride, N,N-dimethyl-N'-(2-pyridyl)-N'-(2-thienylmethyl)ethane-1,2-diamine;hydrochloride, N,N-dimethyl-N'-pyridin-2-yl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine;hydrochloride, dimethyl-[2-[2-pyridyl(2-thenyl)amino]ethyl]amine;hydrochloride
Molecular formula C14H19N3S.HCl, C14H20ClN3S
Molecular mass 297.855
Monoisotopic mass 297.10665
SMILES CN(C)CCN(CC1=CC=CS1)C2=CC=CC=N2.Cl, CN(C)CCN(Cc1cccs1)c1ccccn1.Cl

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 08a91e70-3ddc-11dd-a22e-0050c2490048 methapyrilene hydochloride

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 methapyrilene hydochloride Emissions/Emissions to water/Emissions to water, unspecified kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=methapyrilenehydochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=135-23-9; added Common Chemistry CAS names as altLabel: 1,2-Ethanediamine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-2-pyridinyl-<em>N</em>′-(2-thienylmethyl)-, monohydrochloride, 1,2-Ethanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>1</sup>-dimethyl-<em>N</em><sup>2</sup>-2-pyridinyl-<em>N</em><sup>2</sup>-(2-thienylmethyl)-, hydrochloride (1:1), 2-[[2-(Dimethylamino)ethyl]-2-thenylamino]pyridine hydrochloride, <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-thenyl)-<em>N</em>′-(2-pyridyl-ethylene-diamine hydrochloride), Barhist, Blue Line, Bu-pyra-hist, Bu-pyra-histrit, Butyl-pyra-hist, Capathyn, Cohistine, Coryzol, Histadyl, Histafed, Lullamin, Methacon, Methapyrilene hydrochloride, Pyrathyn, Pyridine, 2-[[2-(dimethylamino)ethyl]-2-thenylamino]-, monohydrochloride, Somnicaps, Tem-Histine, Teralin; object_uuid=fo-55a72387c9744fac
cas_match_labels 1 — consensus_match group_key=methapyrilenehydochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory']; cas_sources={'135-23-9': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-55a72387c9744fac: {'135-23-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '2-((2-(Dimethylamino)ethyl)-2-thenylamino)pyridine monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-((2-(Dimethylamino)ethyl)-2-thenylamino)pyridine monohydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Methoxylene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Methoxylene', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N,N-dimethyl-N'-pyridin-2-yl-N'-[(thiophen-2-yl)methyl]ethane-1,2-diamine hydrochloride", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N,N-dimethyl-N'-pyridin-2-yl-N'-[(thiophen-2-yl)methyl]ethane-1,2-diamine hydrochloride", 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Thenylene hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Thenylene hydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Thenylpyramine hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Thenylpyramine hydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'methypyrilene hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:methypyrilene hydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '2-((2-(Dimethylamino)ethyl)-2-thenylamino)pyridine monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-((2-(Dimethylamino)ethyl)-2-thenylamino)pyridine monohydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Methoxylene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Methoxylene', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N,N-dimethyl-N'-pyridin-2-yl-N'-[(thiophen-2-yl)methyl]ethane-1,2-diamine hydrochloride", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N,N-dimethyl-N'-pyridin-2-yl-N'-[(thiophen-2-yl)methyl]ethane-1,2-diamine hydrochloride", 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Thenylene hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Thenylene hydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Thenylpyramine hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Thenylpyramine hydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'methypyrilene hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:methypyrilene hydrochloride', 'http://purl.obolibrary.org/obo/CHEBI_38213', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1,2-Ethanediamine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-2-pyridinyl-<em>N</em>′-(2-thienylmethyl)-, monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,2-Ethanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>1</sup>-dimethyl-<em>N</em><sup>2</sup>-2-pyridinyl-<em>N</em><sup>2</sup>-(2-thienylmethyl)-, hydrochloride (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-[[2-(Dimethylamino)ethyl]-2-thenylamino]pyridine hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-thenyl)-<em>N</em>′-(2-pyridyl-ethylene-diamine hydrochloride)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Barhist', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Blue Line', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bu-pyra-hist', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bu-pyra-histrit', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyl-pyra-hist', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Capathyn', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cohistine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Coryzol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Histadyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Histafed', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Lullamin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methacon', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methapyrilene hydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pyrathyn', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pyridine, 2-[[2-(dimethylamino)ethyl]-2-thenylamino]-, monohydrochloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Somnicaps', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tem-Histine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Teralin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:135-23-9', 'https://commonchemistry.cas.org/detail?cas_rn=135-23-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=methapyrilenehydochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=135-23-9; added Common Chemistry CAS names as altLabel: 1,2-Ethanediamine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-2-pyridinyl-<em>N</em>′-(2-thienylmethyl)-, monohydrochloride, 1,2-Ethanediamine, <em>N</em><sup>1</sup>,<em>N</em><sup>1</sup>-dimethyl-<em>N</em><sup>2</sup>-2-pyridinyl-<em>N</em><sup>2</sup>-(2-thienylmethyl)-, hydrochloride (1:1), 2-[[2-(Dimethylamino)ethyl]-2-thenylamino]pyridine hydrochloride, <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-thenyl)-<em>N</em>′-(2-pyridyl-ethylene-diamine hydrochloride), Barhist, Blue Line, Bu-pyra-hist, Bu-pyra-histrit, Butyl-pyra-hist, Capathyn, Cohistine, Coryzol, Histadyl, Histafed, Lullamin, Methacon, Methapyrilene hydrochloride, Pyrathyn, Pyridine, 2-[[2-(dimethylamino)ethyl]-2-thenylamino]-, monohydrochloride, Somnicaps, Tem-Histine, Teralin; object_uuid=fo-55a72387c9744fac
cas_match_labels None {'135-23-9': 'exactMatch'} group_key=methapyrilenehydochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory']; cas_sources={'135-23-9': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-55a72387c9744fac: {'135-23-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "08a91e70-3ddc-11dd-a22e-0050c2490048",
  "name": null,
  "cas_numbers": [
    "135-23-9"
  ],
  "ec_numbers": [
    "205-184-8"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
    {
      "method_uuid": "2299222a-bbd8-474f-9d4f-4dd1f18aea7c",
      "name": "Human toxicity, cancer",
      "methodology": "Environmental Footprint",
      "impact_category": "Cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh) ",
      "characterization_factor": 7.0532e-6
    },
    {
      "method_uuid": "503699e0-eca9-4089-8bf8-e0f49c93e578",
      "name": "Human toxicity, cancer_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh) ",
      "characterization_factor": 7.0532e-6
    }
  ],
  "source": "EF 3.1",
  "identifier": "08a91e70-3ddc-11dd-a22e-0050c2490048",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "08a91e70-3ddc-11dd-a22e-0050c2490048",
      "source_flow_name": "methapyrilene hydochloride",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
          "Emissions to water",
          "Emissions to water, unspecified"
        ]
      }
    }
  ],
  "prefLabel": [
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      "@value": "Methapyrilene Hydrochloride",
      "@language": "en",
      "source": {
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  "_sources": {
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    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "enrich_references",
    "skos:definition": "enrich_references",
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  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
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      "@value": [
        "C14H19N3S.HCl",
        "C14H20ClN3S"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": [
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          "prov:wasDerivedFrom": "chebi.basic_property_values.generalized_empirical_formula"
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          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CN(C)CCN(CC1=CC=CS1)C2=CC=CC=N2.Cl",
        "CN(C)CCN(Cc1cccs1)c1ccccn1.Cl"
      ],
      "rdfs:label": "SMILES",
      "provenance": [
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C14H19N3S.ClH/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;/h3-8,11H,9-10,12H2,1-2H3;1H"
      ],
      "rdfs:label": "InChI",
      "provenance": [
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