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Citronellal

UUID 03cd3164-3139-415b-ada8-f3d2538dc97d
Flow Object IDfo-e7f952386aecf26e
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 106-23-0
EC Numbers 203-376-6
prefLabel ⓘ
Language Value Provenance
en Citronellal
altLabel ⓘ
Language Value Provenance
en 2,3-dihydrocitral
en 3,7-dimethyl-6-octen-1-al
en 3,7-dimethyl-6-octenal
en beta-citronellal
en (±)-Citronellal
en 3,7-Dimethyloct-6-en-1-al
en 6-Octenal, 3,7-dimethyl-
en <em>dl</em>-Citronellal
en <em>rac</em>-Citronellal
en NSC 46106
en Rac-citronellal
en Rhodinal
en β-Citronellal
Definitions
Language Value Provenance
en A monoterpenoid, the main component of citronella oil which gives it its distinctive lemon aroma.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey NEHNMFOYXAPHSD-UHFFFAOYSA-N
InChI InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3
IUPAC name 3,7-dimethyl-6-octenal, 3,7-dimethyloct-6-enal
Molecular formula C10H18O
Molecular mass 154.253
Monoisotopic mass 154.13577
SMILES CC(CCC=C(C)C)CC=O, [H]C(=O)CC(C)CCC=C(C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 03cd3164-3139-415b-ada8-f3d2538dc97d 3,7-dimethyloct-6-enal

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 3,7-dimethyloct-6-enal Emissions/Emissions to soil/Emissions to non-agricultural soil kg exactMatch —

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=3,7-dimethyloct-6-enal||dimension=Environmental > media=Ground > geography=Unknown; cas=106-23-0; added Common Chemistry CAS names as altLabel: (±)-Citronellal, 3,7-Dimethyloct-6-en-1-al, 6-Octenal, 3,7-dimethyl-, <em>dl</em>-Citronellal, <em>rac</em>-Citronellal, NSC 46106, Rac-citronellal, Rhodinal, β-Citronellal; object_uuid=fo-e7f952386aecf26e
cas_match_labels 1 — consensus_match group_key=3,7-dimethyloct-6-enal||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'106-23-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e7f952386aecf26e: {'106-23-0': 'exactMatch'}
prefLabel 1 — consensus_match cas=106-23-0; cc_chebi_agreed_name='Citronellal'; object_uuid=fo-e7f952386aecf26e

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': '3,7-dimethyloct-6-enal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=106-23-0; cc_chebi_agreed_name='Citronellal'; object_uuid=fo-e7f952386aecf26e
altLabel [{'@value': '2,3-dihydrocitral', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,3-dihydrocitral', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octen-1-al', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octen-1-al', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octenal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octenal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'beta-citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:beta-citronellal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '2,3-dihydrocitral', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,3-dihydrocitral', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octen-1-al', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octen-1-al', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octenal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octenal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'beta-citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:beta-citronellal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyloct-6-enal', '@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=106-23-0; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-e7f952386aecf26e
altLabel [{'@value': '2,3-dihydrocitral', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,3-dihydrocitral', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octen-1-al', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octen-1-al', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octenal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octenal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'beta-citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:beta-citronellal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyloct-6-enal', '@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': '2,3-dihydrocitral', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,3-dihydrocitral', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octen-1-al', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octen-1-al', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3,7-dimethyl-6-octenal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,7-dimethyl-6-octenal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'beta-citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:beta-citronellal', 'http://purl.obolibrary.org/obo/CHEBI_47856', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(±)-Citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3,7-Dimethyloct-6-en-1-al', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '6-Octenal, 3,7-dimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>dl</em>-Citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>rac</em>-Citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 46106', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Rac-citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Rhodinal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'β-Citronellal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:106-23-0', 'https://commonchemistry.cas.org/detail?cas_rn=106-23-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=3,7-dimethyloct-6-enal||dimension=Environmental > media=Ground > geography=Unknown; cas=106-23-0; added Common Chemistry CAS names as altLabel: (±)-Citronellal, 3,7-Dimethyloct-6-en-1-al, 6-Octenal, 3,7-dimethyl-, <em>dl</em>-Citronellal, <em>rac</em>-Citronellal, NSC 46106, Rac-citronellal, Rhodinal, β-Citronellal; object_uuid=fo-e7f952386aecf26e
cas_match_labels None {'106-23-0': 'exactMatch'} group_key=3,7-dimethyloct-6-enal||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'106-23-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e7f952386aecf26e: {'106-23-0': '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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  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 6.4928e-9
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    {
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
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  "source": "EF 3.1",
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