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Pseudoionone

UUID 5ee77c40-589f-4bf6-8d0d-bca444a0f09f
Deprecated yes
Replaced By 16cf8133-6cb8-4e4a-b5e0-890a75fd4a4e
Flow Object IDfo-35e6cfdc9659a84d
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 141-10-6
EC Numbers 205-457-1
prefLabel ⓘ
Language Value Provenance
en Pseudoionone
altLabel ⓘ
Language Value Provenance
en (3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one
en 2,6-Dimethylundeca-2,6,8-triene-10-one
en 6,10-Dimethyl-3,5,9-undecatrien-2-one
en 6,10-Dimethyl-3,5,9-undecatriene-2-one
en Citrylideneacetone
en 2,6-Dimethyl-2,6,8-undecatrien-10-one
en 2,6-Dimethylhendeca-2,6,8-trien-10-one
en 2-Pseudoionone
en 2-Pseudojonon
en 3,5,9-Undecatrien-2-one, 6,10-dimethyl-
en φ-Ionone
en ψ-Ionone
Definitions
Language Value Provenance
en A terpene ketone derived from ring cleavage of the apo carotenoid β-ionone.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey JXJIQCXXJGRKRJ-KOOBJXAQSA-N
InChI InChI=1S/C13H20O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h6-7,9-10H,5,8H2,1-4H3/b10-6+,12-9+
IUPAC name (3E,5E)-6,10-dimethyl-2-undeca-3,5,9-trienone, (3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one
Molecular formula C13H20O
Molecular mass 192.302
Monoisotopic mass 192.15142
SMILES CC(=CCC/C(=C/C=C/C(=O)C)/C)C, CC(=CCCC(=CC=CC(=O)C)C)C, CC(=O)/C=C/C=C(C)CCC=C(C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 5ee77c40-589f-4bf6-8d0d-bca444a0f09f 6,10-dimethylundeca-3,5,9-trien-2-one

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=6,10-dimethylundeca-3,5,9-trien-2-one||dimension=Environmental > media=Water > water_body=Unknown; cas=141-10-6; added Common Chemistry CAS names as altLabel: 2,6-Dimethyl-2,6,8-undecatrien-10-one, 2,6-Dimethylhendeca-2,6,8-trien-10-one, 2-Pseudoionone, 2-Pseudojonon, 3,5,9-Undecatrien-2-one, 6,10-dimethyl-, φ-Ionone, ψ-Ionone; object_uuid=fo-35e6cfdc9659a84d
cas_match_labels 1 — consensus_match group_key=6,10-dimethylundeca-3,5,9-trien-2-one||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'141-10-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35e6cfdc9659a84d: {'141-10-6': 'exactMatch'}
prefLabel 1 — consensus_match cas=141-10-6; cc_chebi_agreed_name='Pseudoionone'; object_uuid=fo-35e6cfdc9659a84d

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': '6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Pseudoionone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=141-10-6; cc_chebi_agreed_name='Pseudoionone'; object_uuid=fo-35e6cfdc9659a84d
altLabel [{'@value': '(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6-Dimethylundeca-2,6,8-triene-10-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,6-Dimethylundeca-2,6,8-triene-10-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatrien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatrien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatriene-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatriene-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Citrylideneacetone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Citrylideneacetone', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6-Dimethylundeca-2,6,8-triene-10-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,6-Dimethylundeca-2,6,8-triene-10-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatrien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatrien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatriene-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatriene-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Citrylideneacetone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Citrylideneacetone', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=141-10-6; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-35e6cfdc9659a84d
altLabel [{'@value': '(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6-Dimethylundeca-2,6,8-triene-10-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,6-Dimethylundeca-2,6,8-triene-10-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatrien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatrien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatriene-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatriene-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Citrylideneacetone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Citrylideneacetone', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': '(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(3E,5E)-6,10-dimethylundeca-3,5,9-trien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6-Dimethylundeca-2,6,8-triene-10-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,6-Dimethylundeca-2,6,8-triene-10-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatrien-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatrien-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '6,10-Dimethyl-3,5,9-undecatriene-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:6,10-Dimethyl-3,5,9-undecatriene-2-one', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Citrylideneacetone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Citrylideneacetone', 'http://purl.obolibrary.org/obo/CHEBI_67207', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6-Dimethyl-2,6,8-undecatrien-10-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,6-Dimethylhendeca-2,6,8-trien-10-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Pseudoionone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Pseudojonon', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3,5,9-Undecatrien-2-one, 6,10-dimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'φ-Ionone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ψ-Ionone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:141-10-6', 'https://commonchemistry.cas.org/detail?cas_rn=141-10-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=6,10-dimethylundeca-3,5,9-trien-2-one||dimension=Environmental > media=Water > water_body=Unknown; cas=141-10-6; added Common Chemistry CAS names as altLabel: 2,6-Dimethyl-2,6,8-undecatrien-10-one, 2,6-Dimethylhendeca-2,6,8-trien-10-one, 2-Pseudoionone, 2-Pseudojonon, 3,5,9-Undecatrien-2-one, 6,10-dimethyl-, φ-Ionone, ψ-Ionone; object_uuid=fo-35e6cfdc9659a84d
cas_match_labels None {'141-10-6': 'exactMatch'} group_key=6,10-dimethylundeca-3,5,9-trien-2-one||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'141-10-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35e6cfdc9659a84d: {'141-10-6': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
  "cas_numbers": [
    "141-10-6"
  ],
  "ec_numbers": [
    "205-457-1"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
    {
      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 19.863
    },
    {
      "method_uuid": "7cfdcfcf-b222-4b26-888a-a55f9fbf7ac8",
      "name": "Human toxicity, non-cancer",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 2.6616e-7
    },
    {
      "method_uuid": "8c3141e9-1f15-43b5-bff2-182e49893a46",
      "name": "Human toxicity, non-cancer_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 2.6616e-7
    },
    {
      "method_uuid": "fd530f00-9325-424a-92ef-aaac67922fd9",
      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 19.863
    }
  ],
  "source": "EF 3.1",
  "identifier": "5ee77c40-589f-4bf6-8d0d-bca444a0f09f",
  "input_datasets": [
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  "source_refs": [
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      "source_flow_uuid": "5ee77c40-589f-4bf6-8d0d-bca444a0f09f",
      "source_flow_name": "6,10-dimethylundeca-3,5,9-trien-2-one",
      "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 soil",
          "Emissions to soil, unspecified"
        ]
      }
    }
  ],
  "prefLabel": [
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      "@value": "Pseudoionone",
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  "_sources": {
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    "properties": "enrich_references",
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  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
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      "@value": [
        "C13H20O"
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      "rdfs:label": "Molecular formula",
      "provenance": [
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
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    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
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      ],
      "rdfs:label": "InChI",
      "provenance": [
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "rdfs:label": "InChIKey",
      "provenance": [
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