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Pyrethrin I

UUID
Flow Object IDfo-4aa7c378cc8c7cd8
Source ecoinvent algorithm addition
Context Environmental → Ground → Silvicultural
CAS Numbers 121-21-1
EC Numbers 204-455-8
prefLabel
Language Value Provenance
en Pyrethrin I —
altLabel
Language Value Provenance
en (+)-Pyrethronyl (+)-<em>trans</em>-chrysanthemate —
en (1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dien-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate —
en chrysanthemum monocarboxylic acid pyrethrolone ester —
en Chrysanthemummonocarboxylic acid pyrethrolone ester —
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2,4-pentadien-1-yl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)- —
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2,4-pentadienyl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)- —
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2,4-pentadienyl)-2-cyclopenten-1-yl ester, [1<em>R</em>-[1α[<em>S</em>*(<em>Z</em>)],3β]]- —
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2,4-pentadienyl)-2-cyclopenten-1-one —
en Pyrethrin 1 —
en Pyrethrin A —
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey ROVGZAWFACYCSP-VUMXUWRFSA-N
InChI InChI=1S/C21H28O3/c1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8-/t16-,18+,19+/m1/s1
IUPAC name cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid [(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]-1-cyclopent-2-enyl] ester, cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid [(1S)-4-keto-2-methyl-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] ester, cis-[(1S)-2-methyl-4-oxidanylidene-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, cis-[(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, cis-[(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate
Molecular formula C21H28O3
Molecular mass 328.452
Monoisotopic mass 328.20384
SMILES C=C/C=CCC1=C(C)[C@@H](OC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)CC1=O, CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C, CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2(C)C)C=C(C)C)C/C=C\C=C

Source List References

List Version Source Flow UUID Source Flow Name
ecoinvent 3.12 948d6254-1e28-5acf-b2e9-7864e5c36590 Pyrethrin I

Consolidated Field Provenance

No consolidated field provenance found for this flow.

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
strataSilvicultural

Consensus Changes

No consensus_match changes found in the current transform log for this flow.

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "flow_object_id": "fo-4aa7c378cc8c7cd8",
  "source": "ecoinvent algorithm addition",
  "source_refs": [
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      "source_flow_name": "Pyrethrin I",
      "source_metadata": {
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          "forestry"
        ],
        "unit": "kg",
        "cas_number": "121-21-1",
        "ec_number": "",
        "merge_basis": "cas",
        "merge_method": "algorithmic_fallback",
        "selector_reason": "new-elementary-flow-created",
        "notes": "",
        "extra_fields": {},
        "mapping_file": "ecoinvent-3.11-biosphere-EF-3.1-biosphere",
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            "algorithm.elementary_candidates=11",
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            "algorithm.winning_score=3",
            "algorithm.tie_on_top_score=true"
          ],
          "prov:wasDerivedFrom": "algorithmic_fallback:lookup_order(cas>ec>label);basis(cas:121-21-1);flow_object_candidates(1);elementary_candidates(11);selector(new-elementary-flow-created);exact-iri-shortcircuit;up-tree-filter;score=(2*unit_exact)+context_overlap-context_penalty"
        },
        "merge_details": {
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          "elementary_candidate_count": 11,
          "eligible_candidate_count": 2,
          "filtered_out_context_mismatch_count": 9,
          "required_dimension": "Environmental",
          "required_media": "Ground",
          "selector_model": "exact-iri-shortcircuit;up-tree-filter;score=(2*unit_exact)+context_overlap-context_penalty",
          "top_candidates": [
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              "context_overlap": 2,
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              "unit": "kg",
              "context": [
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              "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-unkn"
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              "context_penalty": 1,
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              "context": [
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                "Agricultural"
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              "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-agri"
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          "scored_candidates": [
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              "context": [
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              "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-unkn"
            },
            {
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              "score": 3,
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              "unit": "kg",
              "context": [
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            }
          ],
          "winning_score": 3,
          "tie_on_top_score": true,
          "source_context_original": [
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            "forestry"
          ],
          "source_context_normalized": [
            "Environmental",
            "Ground",
            "Silvicultural"
          ],
          "source_context_used_for_matching": [
            "Environmental",
            "Ground",
            "Silvicultural"
          ],
          "source_context_matching_basis": "normalized"
        }
      }
    }
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "strata": "Silvicultural"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-silv",
  "unit": "kg",
  "unit_iri": null,
  "lcia_methods": [],
  "general_comment": "",
  "concept_associations": [],
  "prefLabel": [
    {
      "@value": "Pyrethrin I",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "prefLabel"
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    }
  ],
  "altLabel": [
    {
      "@value": "(+)-Pyrethronyl (+)-<em>trans</em>-chrysanthemate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dien-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "chrysanthemum monocarboxylic acid pyrethrolone ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Chrysanthemummonocarboxylic acid pyrethrolone ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2,4-pentadien-1-yl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2,4-pentadienyl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2,4-pentadienyl)-2-cyclopenten-1-yl ester, [1<em>R</em>-[1α[<em>S</em>*(<em>Z</em>)],3β]]-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2,4-pentadienyl)-2-cyclopenten-1-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "altLabel"
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    },
    {
      "@value": "Pyrethrin 1",
      "@language": "en",
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        "prov:wasDerivedFrom": "altLabel"
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    },
    {
      "@value": "Pyrethrin A",
      "@language": "en",
      "@lang": "en",
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        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "altLabel"
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  ],
  "properties": {
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      "@value": [
        "C21H28O3"
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      "rdfs:label": "Molecular formula",
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    },
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        "CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C",
        "CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2(C)C)C=C(C)C)C/C=C\\C=C"
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
        "ROVGZAWFACYCSP-VUMXUWRFSA-N"
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      "@value": [
        "cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid [(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]-1-cyclopent-2-enyl] ester",
        "cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid [(1S)-4-keto-2-methyl-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] ester",
        "cis-[(1S)-2-methyl-4-oxidanylidene-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate",
        "cis-[(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate",
        "cis-[(1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate"
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  "references": [
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