← Back to consensus flows

(+/-) Trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol

UUID e729616f-57ff-412b-8c35-7b80bf7ba89a
Deprecated yes
Replaced By ec18c344-982f-4c0a-b73f-80d7f5e2d637
Flow Object IDfo-dc0e902c14e61f0b
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 107898-54-4
EC Numbers 411-580-3
prefLabel
Language Value Provenance
en (+/-) Trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol
altLabel
Language Value Provenance
en 3,3-Dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol
en 4-Penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
en Mysantol
en Polysantol
References
Shared Properties
Predicate Value
InChIKey QZFSNJAQFWEXEA-MDZDMXLPSA-N, QZFSNJAQFWEXEA-UHFFFAOYSA-N
InChI InChI=1S/C15H26O/c1-11-7-8-13(15(11,5)6)9-10-14(3,4)12(2)16/h7,9-10,12-13,16H,8H2,1-6H3, InChI=1S/C15H26O/c1-11-7-8-13(15(11,5)6)9-10-14(3,4)12(2)16/h7,9-10,12-13,16H,8H2,1-6H3/b10-9+
IUPAC name (E)-3,3-dimethyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)-4-penten-2-ol, (E)-3,3-dimethyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)-4-penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol
Molecular formula C15H26O
SMILES CC1=CCC(C1(C)C)/C=C/C(C)(C)C(C)O, CC1=CCC(C1(C)C)C=CC(C)(C)C(C)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 e729616f-57ff-412b-8c35-7b80bf7ba89a (+/-) trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol

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=(+/-)trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=107898-54-4; added Common Chemistry CAS names as altLabel: 3,3-Dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol, 4-Penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, Mysantol, Polysantol; object_uuid=fo-dc0e902c14e61f0b
cas_match_labels 1 consensus_match group_key=(+/-)trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'107898-54-4': []}; assigned CAS labels from group consensus; object_uuid=fo-dc0e902c14e61f0b: {'107898-54-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '3,3-Dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:107898-54-4', 'https://commonchemistry.cas.org/detail?cas_rn=107898-54-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:107898-54-4', 'https://commonchemistry.cas.org/detail?cas_rn=107898-54-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Mysantol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:107898-54-4', 'https://commonchemistry.cas.org/detail?cas_rn=107898-54-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Polysantol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:107898-54-4', 'https://commonchemistry.cas.org/detail?cas_rn=107898-54-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=(+/-)trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=107898-54-4; added Common Chemistry CAS names as altLabel: 3,3-Dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol, 4-Penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, Mysantol, Polysantol; object_uuid=fo-dc0e902c14e61f0b
cas_match_labels None {'107898-54-4': 'exactMatch'} group_key=(+/-)trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=[]; cas_sources={'107898-54-4': []}; assigned CAS labels from group consensus; object_uuid=fo-dc0e902c14e61f0b: {'107898-54-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "e729616f-57ff-412b-8c35-7b80bf7ba89a",
  "name": null,
  "cas_numbers": [
    "107898-54-4"
  ],
  "ec_numbers": [
    "411-580-3"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "e729616f-57ff-412b-8c35-7b80bf7ba89a",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "e729616f-57ff-412b-8c35-7b80bf7ba89a",
      "source_flow_name": "(+/-) trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol",
      "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 (long-term)"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "(+/-) Trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_sources": {
    "prefLabel": "normalize_name_case",
    "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",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C15H26O"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303",
          "CID:53425103"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "QZFSNJAQFWEXEA-MDZDMXLPSA-N",
        "QZFSNJAQFWEXEA-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303",
          "CID:53425103"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CC1=CCC(C1(C)C)/C=C/C(C)(C)C(C)O",
        "CC1=CCC(C1(C)C)C=CC(C)(C)C(C)O"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303",
          "CID:53425103"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C15H26O/c1-11-7-8-13(15(11,5)6)9-10-14(3,4)12(2)16/h7,9-10,12-13,16H,8H2,1-6H3",
        "InChI=1S/C15H26O/c1-11-7-8-13(15(11,5)6)9-10-14(3,4)12(2)16/h7,9-10,12-13,16H,8H2,1-6H3/b10-9+"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303",
          "CID:53425103"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "(E)-3,3-dimethyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)-4-penten-2-ol",
        "(E)-3,3-dimethyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol",
        "3,3-dimethyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)-4-penten-2-ol",
        "3,3-dimethyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303",
          "CID:53425103"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.023.528D",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.101.101",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.122.363",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=107898-54-4",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53425103;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=244626-73-1",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID401021085",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID7051551",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53425103;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/15984303",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:15984303;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[107898-54-4]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/53425103",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53425103;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[107898-54-4]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q72501662",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53425103;CAS:107898-54-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[107898-54-4]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "3,3-Dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:107898-54-4",
          "https://commonchemistry.cas.org/detail?cas_rn=107898-54-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-Penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:107898-54-4",
          "https://commonchemistry.cas.org/detail?cas_rn=107898-54-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mysantol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:107898-54-4",
          "https://commonchemistry.cas.org/detail?cas_rn=107898-54-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Polysantol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:107898-54-4",
          "https://commonchemistry.cas.org/detail?cas_rn=107898-54-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "107898-54-4": "exactMatch"
  },
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:ec18c344-982f-4c0a-b73f-80d7f5e2d637",
  "is_replaced_by_uuid": "ec18c344-982f-4c0a-b73f-80d7f5e2d637",
  "flow_object_id": "fo-dc0e902c14e61f0b"
}