3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl Heptanoate (non-preferred Name)

← Back to consensus flows

3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl Heptanoate (non-preferred Name)

UUID 794a7ede-9ac1-4b28-8c22-495e1f5980f5

Flow Object ID fo-e1e032696d3ac0a8

Source EF 3.1

Context Environmental → Water → Unknown

CAS Numbers 25811-35-2

EC Numbers 247-279-7

prefLabel

Language	Value	Provenance
`en`	`3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl Heptanoate (non-preferred Name)`

altLabel ⓘ

Language	Value	Provenance
`en`	`Heptanoic acid, 1,1′-[2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester`
`en`	`Heptanoic acid, 2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester`
`en`	`Heptanoic acid, neopentanetetrayl ester`
`en`	`Pentaerythritol tetra-<em>n</em>-heptanoate`
`en`	`Pentaerythritol tetraenanthate`
`en`	`Pentaerythritol, tetraheptanoate`
`en`	`Pentaerythrityl tetraheptanoate`

References

Shared Properties

Predicate	Value
InChIKey	`LAWLMXPSCYHMNV-UHFFFAOYSA-N, NCGQPNAQUYGWMI-UHFFFAOYSA-N`
InChI	`InChI=1S/C16H20N2.ClH/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16;/h3-10,12,15H,11,13H2,1-2H3;1H, InChI=1S/C33H60O8/c1-5-9-13-17-21-29(34)38-25-33(26-39-30(35)22-18-14-10-6-2,27-40-31(36)23-19-15-11-7-3)28-41-32(37)24-20-16-12-8-4/h5-28H2,1-4H3`
IUPAC name	N,N-dimethyl-3-phenyl-3-(2-pyridinyl)-1-propanamine;hydrochloride, N,N-dimethyl-3-phenyl-3-(2-pyridyl)propan-1-amine;hydrochloride, N,N-dimethyl-3-phenyl-3-pyridin-2-yl-propan-1-amine;hydrochloride, N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine;hydrochloride, [3-heptanoyloxy-2,2-bis(heptanoyloxymethyl)propyl] heptanoate, dimethyl-[3-phenyl-3-(2-pyridyl)propyl]amine;hydrochloride, enanthic acid [3-enanthyloxy-2,2-bis(enanthyloxymethyl)propyl] ester, heptanoic acid [3-(1-oxoheptoxy)-2,2-bis(1-oxoheptoxymethyl)propyl] ester
Molecular formula	`C16H21ClN2, C33H60O8`
SMILES	`CCCCCCC(=O)OCC(COC(=O)CCCCCC)(COC(=O)CCCCCC)COC(=O)CCCCCC, CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2.Cl`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`794a7ede-9ac1-4b28-8c22-495e1f5980f5`	3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl heptanoate (non-preferred name)

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl heptanoate (non-preferred name)	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=3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propylheptanoate(non-preferredname)\|\|dimension=Environmental > media=Air > indoor=Unknown; cas=25811-35-2; added Common Chemistry CAS names as altLabel: Heptanoic acid, 1,1′-[2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester, Heptanoic acid, 2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester, Heptanoic acid, neopentanetetrayl ester, Pentaerythritol tetra-<em>n</em>-heptanoate, Pentaerythritol tetraenanthate, Pentaerythritol, tetraheptanoate, Pentaerythrityl tetraheptanoate; object_uuid=fo-e1e032696d3ac0a8
`cas_match_labels`	1	`—`	consensus_match	group_key=3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propylheptanoate(non-preferredname)\|\|dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'25811-35-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-e1e032696d3ac0a8: {'25811-35-2': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': 'Heptanoic acid, 1,1′-[2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Heptanoic acid, 2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Heptanoic acid, neopentanetetrayl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentaerythritol tetra-<em>n</em>-heptanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentaerythritol tetraenanthate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentaerythritol, tetraheptanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentaerythrityl tetraheptanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25811-35-2', 'https://commonchemistry.cas.org/detail?cas_rn=25811-35-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propylheptanoate(non-preferredname)\|\|dimension=Environmental > media=Air > indoor=Unknown; cas=25811-35-2; added Common Chemistry CAS names as altLabel: Heptanoic acid, 1,1′-[2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester, Heptanoic acid, 2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester, Heptanoic acid, neopentanetetrayl ester, Pentaerythritol tetra-<em>n</em>-heptanoate, Pentaerythritol tetraenanthate, Pentaerythritol, tetraheptanoate, Pentaerythrityl tetraheptanoate; object_uuid=fo-e1e032696d3ac0a8
`cas_match_labels`	`None`	`{'25811-35-2': 'exactMatch'}`	group_key=3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propylheptanoate(non-preferredname)\|\|dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'25811-35-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-e1e032696d3ac0a8: {'25811-35-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "794a7ede-9ac1-4b28-8c22-495e1f5980f5",
  "name": null,
  "cas_numbers": [
    "25811-35-2"
  ],
  "ec_numbers": [
    "247-279-7"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "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": 0.068015
    },
    {
      "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": 3.7606e-10
    },
    {
      "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": 3.7606e-10
    },
    {
      "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": 0.068015
    }
  ],
  "source": "EF 3.1",
  "identifier": "794a7ede-9ac1-4b28-8c22-495e1f5980f5",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "794a7ede-9ac1-4b28-8c22-495e1f5980f5",
      "source_flow_name": "3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl heptanoate (non-preferred name)",
      "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": [
    {
      "@value": "3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl Heptanoate (non-preferred Name)",
      "@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": [
        "C16H21ClN2",
        "C33H60O8"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402",
          "CID:117642"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "LAWLMXPSCYHMNV-UHFFFAOYSA-N",
        "NCGQPNAQUYGWMI-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402",
          "CID:117642"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CCCCCCC(=O)OCC(COC(=O)CCCCCC)(COC(=O)CCCCCC)COC(=O)CCCCCC",
        "CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2.Cl"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402",
          "CID:117642"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C16H20N2.ClH/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16;/h3-10,12,15H,11,13H2,1-2H3;1H",
        "InChI=1S/C33H60O8/c1-5-9-13-17-21-29(34)38-25-33(26-39-30(35)22-18-14-10-6-2,27-40-31(36)23-19-15-11-7-3)28-41-32(37)24-20-16-12-8-4/h5-28H2,1-4H3"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402",
          "CID:117642"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "N,N-dimethyl-3-phenyl-3-(2-pyridinyl)-1-propanamine;hydrochloride",
        "N,N-dimethyl-3-phenyl-3-(2-pyridyl)propan-1-amine;hydrochloride",
        "N,N-dimethyl-3-phenyl-3-pyridin-2-yl-propan-1-amine;hydrochloride",
        "N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine;hydrochloride",
        "[3-heptanoyloxy-2,2-bis(heptanoyloxymethyl)propyl] heptanoate",
        "dimethyl-[3-phenyl-3-(2-pyridyl)propyl]amine;hydrochloride",
        "enanthic acid [3-enanthyloxy-2,2-bis(enanthyloxymethyl)propyl] ester",
        "heptanoic acid [3-(1-oxoheptoxy)-2,2-bis(1-oxoheptoxymethyl)propyl] ester"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402",
          "CID:117642"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J106.231J",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.042.967",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID50180467",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID80948173",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/10P41DI6MI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/750HPD2T6W",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/117642",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[25811-35-2]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/91402",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[25811-35-2]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27251155",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:91402;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27266319",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:117642;CAS:25811-35-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[25811-35-2]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Heptanoic acid, 1,1′-[2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl] ester",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Heptanoic acid, 2,2-bis[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Heptanoic acid, neopentanetetrayl ester",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pentaerythritol tetra-<em>n</em>-heptanoate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pentaerythritol tetraenanthate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pentaerythritol, tetraheptanoate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pentaerythrityl tetraheptanoate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25811-35-2",
          "https://commonchemistry.cas.org/detail?cas_rn=25811-35-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "25811-35-2": "exactMatch"
  },
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/794a7ede-9ac1-4b28-8c22-495e1f5980f5",
        "skos:prefLabel": "3-(heptanoyloxy)-2,2-bis[(heptanoyloxy)methyl]propyl heptanoate (non-preferred name)",
        "context": "Emissions/Emissions to water/Emissions to water, unspecified",
        "qudt:unit": "kg"
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/794a7ede-9ac1-4b28-8c22-495e1f5980f5"
      },
      "xkos:mapType": {
        "@id": "http://www.w3.org/2004/02/skos/core#exactMatch"
      },
      "provenance": {
        "prov:wasGeneratedBy": "build_concept_associations",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "https://eplca.jrc.ec.europa.eu/permalink/EF3_1/EF-v3.1.zip"
        ]
      }
    }
  ],
  "flow_object_id": "fo-e1e032696d3ac0a8"
}