CHEBI:141222 - (4E,6E)-2,6-dimethylocta-2,4,6-triene

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ChEBI Name (4E,6E)-2,6-dimethylocta-2,4,6-triene
ChEBI ID CHEBI:141222
ChEBI ASCII Name (4E,6E)-2,6-dimethylocta-2,4,6-triene
Definition An ocimene that consists of octa-2,4,6-triene bearing methyl substituents at positions 2 and 6 (the 4E,6E-isomer).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H16
Net Charge 0
Average Mass 136.234
Monoisotopic Mass 136.12520
InChI InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-4H3/b8-6+,10-5+
InChIKey GQVMHMFBVWSSPF-SOYUKNQTSA-N
SMILES CC(=C/C=C/C(=C/C)/C)C
Roles Classification
Biological Role(s): semiochemical
A molecular messenger released by an organism that affects the behaviour within or between species.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via ocimene )
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ChEBI Ontology
Outgoing (4E,6E)-2,6-dimethylocta-2,4,6-triene (CHEBI:141222) has role semiochemical (CHEBI:26645)
(4E,6E)-2,6-dimethylocta-2,4,6-triene (CHEBI:141222) is a ocimene (CHEBI:87751)
IUPAC Name
(4E,6E)-2,6-dimethylocta-2,4,6-triene
Synonyms Sources
(4E,6E)-allo-ocimene ChEBI
(4E,6E)-allo-ocimene UniProt
(4E,6E)-allocimene ChemIDplus
(4E,6E)-alloocimene ChemIDplus
(E,E)-2,6-dimethyl-2,4,6-octatriene ChEBI
(E,E)-2,6-dimethyl-2,4,6-octatriene ChemIDplus
trans,trans-allo-ocimene ChEBI
trans,trans-alloocimene ChemIDplus
trans-allo-ocimene ChEBI
trans-alloocimene NIST Chemistry WebBook
Manual Xref Database
LMFA11000042 LIPID MAPS
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Registry Numbers Types Sources
14947-20-7 CAS Registry Number NIST Chemistry WebBook
1719993 Reaxys Registry Number Reaxys
3016-19-1 CAS Registry Number ChemIDplus
Last Modified
31 August 2022