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Heptanoic Acid

UUID 757af398-42db-44de-a292-678a0358adc2
Flow Object IDfo-99796020f3ba73a3
Source EF 3.1
Context Environmental → Air → Aircraft cruise height
CAS Numbers 111-14-8
EC Numbers 203-838-7
prefLabel
Language Value Provenance
en Heptanoic Acid
altLabel ⓘ
Language Value Provenance
en CH3-[CH2]5-COOH
en Heptansaeure
en Oenanthsaeure
en enanthic acid
en enanthylic acid
en heptoic acid
en heptylic acid
en n-heptanoic acid
en n-heptoic acid
en n-heptylic acid
en oenanthic acid
en oenanthylic acid
en 1-Hexanecarboxylic acid
en <em>n</em>-Heptanoic acid
en <em>n</em>-Heptoic acid
en <em>n</em>-Heptylic acid
en Enanthoic acid
en NSC 2192
Definitions
Language Value Provenance
en A C7, straight-chain fatty acid that contributes to the odour of some rancid oils. Used in the preparation of esters for the fragrance industry, and as an additive in cigarettes.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey MNWFXJYAOYHMED-UHFFFAOYSA-N
InChI InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)
IUPAC name enanthic acid, heptanoic acid
Molecular formula C7H14O2
Molecular mass 130.187
Monoisotopic mass 130.09938
SMILES CCCCCCC(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 757af398-42db-44de-a292-678a0358adc2 heptanoic acid

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 heptanoic acid Emissions/Emissions to air/Emissions to lower stratosphere and upper troposphere 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=heptanoicacid||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=111-14-8; added Common Chemistry CAS names as altLabel: 1-Hexanecarboxylic acid, <em>n</em>-Heptanoic acid, <em>n</em>-Heptoic acid, <em>n</em>-Heptylic acid, Enanthoic acid, NSC 2192; object_uuid=fo-99796020f3ba73a3
cas_match_labels 1 — consensus_match group_key=heptanoicacid||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'111-14-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-99796020f3ba73a3: {'111-14-8': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataAircraft cruise height

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': 'CH3-[CH2]5-COOH', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:CH3-[CH2]5-COOH', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Heptansaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Heptansaeure', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oenanthsaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oenanthsaeure', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'enanthic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:enanthic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'enanthylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:enanthylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'heptoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:heptoic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'heptylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:heptylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'n-heptanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:n-heptanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'n-heptoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:n-heptoic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'n-heptylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:n-heptylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'oenanthic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:oenanthic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'oenanthylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:oenanthylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'CH3-[CH2]5-COOH', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:CH3-[CH2]5-COOH', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Heptansaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Heptansaeure', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oenanthsaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oenanthsaeure', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'enanthic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:enanthic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'enanthylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:enanthylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'heptoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:heptoic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'heptylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:heptylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'n-heptanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:n-heptanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'n-heptoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:n-heptoic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'n-heptylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:n-heptylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'oenanthic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:oenanthic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'oenanthylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:oenanthylic acid', 'http://purl.obolibrary.org/obo/CHEBI_45571', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Hexanecarboxylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-14-8', 'https://commonchemistry.cas.org/detail?cas_rn=111-14-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>n</em>-Heptanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-14-8', 'https://commonchemistry.cas.org/detail?cas_rn=111-14-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>n</em>-Heptoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-14-8', 'https://commonchemistry.cas.org/detail?cas_rn=111-14-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>n</em>-Heptylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-14-8', 'https://commonchemistry.cas.org/detail?cas_rn=111-14-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Enanthoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-14-8', 'https://commonchemistry.cas.org/detail?cas_rn=111-14-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 2192', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-14-8', 'https://commonchemistry.cas.org/detail?cas_rn=111-14-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=heptanoicacid||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=111-14-8; added Common Chemistry CAS names as altLabel: 1-Hexanecarboxylic acid, <em>n</em>-Heptanoic acid, <em>n</em>-Heptoic acid, <em>n</em>-Heptylic acid, Enanthoic acid, NSC 2192; object_uuid=fo-99796020f3ba73a3
cas_match_labels None {'111-14-8': 'exactMatch'} group_key=heptanoicacid||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'111-14-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-99796020f3ba73a3: {'111-14-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "name": null,
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  "ec_numbers": [
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    "strata": "Aircraft cruise height"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
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  "source": "EF 3.1",
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        "input_dataset": "EF 3.1",
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          "Emissions to lower stratosphere and upper troposphere"
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